AG0036K0

73-31-4 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide

AG0036K0

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CAS Number	73-31-4
Catalog Number	AG0036K0(AGN-PC-00ANBS)
Chemical Name	N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
EC Number	200-797-7
IUPAC Name	N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
InChI	InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)
InChI Key	DRLFMBDRBRZALE-UHFFFAOYSA-N
MDL Number	MFCD00005655
Molecular Formula	C13H16N2O2
Molecular Weight	232.2783
SMILES	C(C)(=O)NCCC1=CNC2=CC=C(C=C12)OC
UNII	JL5DK93RCL
Synonyms	Melatonin, Melatonin, 73-31-4, Melatonine, N-Acetyl-5-methoxytryptamine, Circadin, 5-Methoxy-N-acetyltryptamine, N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]acetamide, N-(2-(5-Methoxy-1H-indol-3-yl)ethyl)acetamide, Melatol, Melatonex, Melovine, N-[2-(5-methoxyindol-3-yl)ethyl]acetamide, Acetamide, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-, UNII-JL5DK93RCL, N-(2-(5-Methoxyindol-3-yl)ethyl)acetamide, N-acetyl-5-methoxy-tryptamine, NSC 113928, CCRIS 3472, CHEMBL45, EINECS 200-797-7, JL5DK93RCL, Acetamide, N-(2-(5-methoxyindol-3-yl)ethyl)-, BRN 0205542, CHEBI:16796, DRLFMBDRBRZALE-UHFFFAOYSA-N, Acetamide, N-[2-(5-methoxyindol-3-yl)ethyl]-, Melatonine, 99%, Acetamide, N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-, MFCD00005655, N-[2-(5-Methoxy-1H-indol-3-yl)-ethyl]-acetamide, NSC113928, 8041-44-9, MT6, CAS-73-31-4, NCGC00015680-11, 3-(n-acetyl-2-aminoethyl)-5-methoxyindole, DSSTox_CID_2421, DSSTox_RID_76585, DSSTox_GSID_22421, Melapure, Posidorm, Vivitas, Pineal Hormone, Sleep Right, WLN: T56 BMJ D2MV1 GO1, Night Rest, Rx Balance, Revital Melatonin, Nature'S Harmony, [3H]melatonin, Melatonina (TN), Mela-T, [3H]-melatonin, ML1, SMR000326666, N-(2-(5-methoxyindol-3-yl)ethyl)-Acetamide, N-[2-(5-methoxyindol-3-yl)ethyl]-Acetamide, N-[2-(5-Methoxy-1H-indol-3-yl)ethyl)acetamide, SR-01000075559, [3H]MLT, Acetamide, N-(2-(5-methoxy-1H-indol-3-yl)ethyl)- (9CI), Acetamide, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]- (9CI), Melatonine;, Guna-dermo, HSDB 7509, PREVENTION 2 (MELATONIN), PREVENTION 3 (MELATONIN), PREVENTION 4 (MELATONIN), PREVENTION 5 (MELATONIN), Melatonin (JAN), Melatonin (MLT), TNP00300, Prestwick_312, IN1244, PubChem18245, Spectrum_000185, NMR/14327425, Guna-dermo (Salt/Mix), Prestwick0_000458, Prestwick1_000458, Prestwick2_000458, Prestwick3_000458, Spectrum2_001344, Spectrum3_001393, Spectrum4_000066, Spectrum5_001745, Lopac-M-5250, M1105, ChemDiv2_003916, M 5250, Melatonex, 73-31-4, Melatonin, >=99.5%, AC1L1A9Q, AC1Q4F1W, AC1Q4F1X, Lopac0_000787, Oprea1_104553, Oprea1_814234, PREVENTION 1 (MELATONIN) (PREVENTION 1), SCHEMBL19018, BSPBio_000536, BSPBio_003006, GTPL224, KBioGR_000591, KBioSS_000665, 5-22-12-00042 (Beilstein Handbook Reference), Acetamide, {N-[2-(5-methoxyindol-3-yl)ethyl]-}, KSC498C4R, MLS000859594, MLS001055382, MLS001240204, ARONIS24462, BIDD:ER0618, DivK1c_000353, SPECTRUM1500690, SPBio_001527, SPBio_002475, Melatonin (synth.) ultra-pure, ACE073, BDBM9019, BPBio1_000590, GTPL1357, Acetamide, {N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-}, DTXSID1022421, CTK3J8148, HMS501B15, KBio1_000353, KBio2_000665, KBio2_003233, KBio2_005801, KBio3_002226, ZINC57060, Melatonin 1.0 mg/ml in Methanol, NINDS_000353, HMS1380B22, HMS1569K18, HMS1921E04, HMS2089F09, HMS2096K18, HMS2233D23, HMS3262M16, HMS3370J20, HMS3654A22, HMS3677P14, HMS3713K18, Melatonin (synth.) standard-grade, ACT03490, BCP28154, HY-B0075, KS-00000GX9, NSC56423, Tox21_110195, Tox21_201527, Tox21_302926, Tox21_500787, 4-ACETAMIDO-4'-ISOTHIO-CYANATOSTILBENE-2,2'-DISULFONIC ACID, ANW-42685, CCG-38837, CM-539, HSCI1_000400, KM1545, Melatonin, powder, >=98% (TLC), NSC-56423, SBB003265, STK386880, AKOS000276269, Tox21_110195_1, CS-1769, DB01065, KS-1454, LP00787, LS-1623, MCULE-1497884152, NSC-113928, RP17870, RTC-063565, SDCCGMLS-0065812.P001, SDCCGMLS-0065812.P002, IDI1_000353, IDI1_002631, KS-000048J8, SMP2_000309, N-acetyl-5-methoxy-tryptamine Melatonine, NCGC00015680-01, NCGC00015680-02, NCGC00015680-03, NCGC00015680-04, NCGC00015680-05, NCGC00015680-06, NCGC00015680-07, NCGC00015680-08, NCGC00015680-09, NCGC00015680-10, NCGC00015680-12, NCGC00015680-13, NCGC00015680-14, NCGC00015680-15, NCGC00015680-16, NCGC00015680-18, NCGC00090727-01, NCGC00090727-02, NCGC00090727-03, NCGC00090727-04, NCGC00090727-05, NCGC00090727-06, NCGC00090727-07, NCGC00090727-08, NCGC00090727-09, NCGC00256404-01, NCGC00259077-01, NCGC00261472-01, 4CN-3100, AC-10019, AJ-09558, AK110931, BAS 01281092, BC200187, NCI60_004378, SC-16475, ST057260, ZB001948, AB0007332, AB2000011, TC-063565, AB00053279, EU-0100787, FT-0628191, FT-0658928, S1204, ST24031293, SW196607-4, C01598, D08170, J10164, AB00053279-10, AB00053279_12, {N-[2-(5-methoxyindol-3-yl)ethyl]-} Acetamide, 005M655, L001261, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-Acetamide, I05-0076, I10-0345, SR-01000075559-1, SR-01000075559-6, SR-01000075559-7, SR-01000075559-8, {N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-} Acetamide, BRD-K97530723-001-07-6, BRD-K97530723-001-11-8, F1929-1777, Melatonin, British Pharmacopoeia (BP) Reference Standard, 0E2B08C1-B325-45B1-8939-6F9081EFDFA4, A4039/0172195, Acetamide, N-[2-(5-methoxyindol-3-yl)ethyl]- (6CI,8CI), Melatonin, United States Pharmacopeia (USP) Reference Standard, Disodium 4-acetamido-4'-isothiocyanato-stilben-2,2'-disulfonate, Melatonin, Pharmaceutical Secondary Standard; Certified Reference Material, Melatonin solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material, Regulin, Melatonina, Primex, SITS, Melatonex, Melatonin, Melatonin, 99% 5g, D0AN7B, D0B5CB, D0M9SI, C13H16N2O2, CID896, Melatonin, 99% - 1G 1g, C13-H16-N2-O2, ACN-037129, CS-O-11684, M-1200, M-1250, N-(2-(5-methoxyindol-3-yl)ethyl)acetamid, A2842, N-Acetyl-5-Methoxytryptamine also Melatonine, A10564, D008550, Acetamida, n-[2-(5-metoxi-1h-indol-3-il) etil]-, Acetamide, N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-(9CI), Acetamide, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-(9CI), Acetamide, N-[2-(5-methoxyindol-3-yl)ethyl]-(6CI,8CI), Melatonine (1,000 - <lt/> 10,000 microg/ml) in methanol, 51023-76-8, MLT, MEL,

Complexity	270
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	232.121g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	232.283g/mol
Monoisotopic Mass	232.121g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	54.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number