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| CAS Number | 51-12-7 |
| Catalog Number | AG003T2N(AGN-PC-0S9MBZ) |
| Chemical Name | Nialamide |
| EC Number | 200-079-3 |
| IUPAC Name | N-benzyl-3-[2-(pyridine-4-carbonyl)hydrazinyl]propanamide |
| InChI | InChI=1S/C16H18N4O2/c21-15(18-12-13-4-2-1-3-5-13)8-11-19-20-16(22)14-6-9-17-10-7-14/h1-7,9-10,19H,8,11-12H2,(H,18,21)(H,20,22) |
| InChI Key | NOIIUHRQUVNIDD-UHFFFAOYSA-N |
| MDL Number | MFCD00010106 |
| Molecular Formula | C16H18N4O2 |
| Molecular Weight | 298.3397 |
| SMILES | O=C(NNCCC(=O)NCC=1C=CC=CC1)C=2C=CN=CC2 |
| UNII | T2Q0RYM725 |
| Synonyms | Nialamide,
Nialamide,
Nialamid,
Niamidal,
Niaquitil,
Niamid,
Niazin,
51-12-7,
Psicodisten,
Novazid,
Nuredal,
Nyazin,
Surgex,
Mygal,
Delmoneurina,
Isalizina,
Espril,
BEIH,
Delmoneurinaesprilisalizina,
Nialamida,
Nialamidum,
Nialamidum [INN-Latin],
Nialamida [INN-Spanish],
Nyezin,
UNII-T2Q0RYM725,
N-(2-(Benzylcarbamyl)ethylamino)isonicotinamide,
P 1133,
NSC 124514,
CCRIS 3512,
2-(2-(Benzylcarbamyl)ethyl)hydrazide isonicotinic acid,
2-(2-(Benzylcarbamoyl)ethyl)hydrazide isonicotinic acid,
N-Isonicotinyl hydrazide,
EINECS 200-079-3,
Lopac-N-1392,
N-Benzyl-3-(2-isonicotinoylhydrazino)propanamide,
N-Benzyl-beta-(isonicotinoylhydrazine)propionamide,
BRN 0492941,
1-(2-(Benzylcarbamoyl)ethyl)-2-isonicotinoylhydrazine,
MLS000069474,
Isonicotinic acid, 2-(2-(benzylcarbamoyl)ethyl)hydrazide,
N-Isonicotinoyl-N'(beta-N-benzylcarboxamidoethyl)hydrazine,
T2Q0RYM725,
NOIIUHRQUVNIDD-UHFFFAOYSA-N,
4-Pyridinecarboxylic acid, 2-[3-oxo-3-[(phenylmethyl)amino]propyl]hydrazide,
NSC124514,
1-[2-(Benzylcarbamoyl)ethyl]-2-isonicotinoylhydrazine,
Isonicotinic acid 2-((2-benzylcarbamoyl)ethyl)hydrazide,
CAS-51-12-7,
Isonicotinic acid, 2-[2-(benzylcarbamoyl)ethyl]hydrazide,
NCGC00015726-06,
SMR000059131,
N(sup1)-beta-Benzylcarbamoylethyl-N(sup2)-isonicotinoylhydrazine,
N(sup 1)-beta-Benzylcarbamoylethyl-N(sup 2)-isonicotinoylhydrazine,
DSSTox_CID_3362,
4-Pyridinecarboxylic acid 2-(3-oxo-3-((phenylmethyl)amino)propyl)hydrazide,
4-Pyridinecarboxylic acid, 2-(3-oxo-3-((phenylmethyl)amino)propyl)hydrazide,
DSSTox_RID_76991,
DSSTox_GSID_23362,
N-Benzyl-.beta.-(isonicotinylhydrazino)propionamide,
N-Benzyl-.beta.-(isonicotinoylhydrazine)propionamide,
2-[2-(Benzylcarbamoyl)ethyl]hydrazide isonicotinic acid,
Isonicitinic acid 2-[(2-benzylcarbamoyl)ethyl]hydrazide,
Isonicotinic acid, 2-[2-(benzylcarbamoylethyl]hydrazide,
N-benzyl-3-[2-(pyridine-4-carbonyl)hydrazinyl]propanamide,
N-Isonicotinoyl-N'-(.beta.-N-benzylcarboxamidoethyl)hydrazine,
4-Pyridinecarboxylic acid 2-[3-oxo-3-[(phenylmethyl)amino]propyl]hydrazide,
Nialamide [INN:BAN],
SR-01000000028,
Nialamide [INN:BAN:NF],
HSDB 7698,
Nialamide (INN),
Nialamide, 95%,
Niamid (TN),
nialamide (substance),
NF-XIII,
Opera_ID_1336,
Prestwick0_001099,
Prestwick1_001099,
Prestwick2_001099,
Prestwick3_001099,
CBChromo1_000220,
AC1L1I8S,
AC1Q5HC8,
Nucleic Acid Electrophoresis,
Lopac0_000865,
SCHEMBL49430,
BSPBio_001178,
5-22-02-00251 (Beilstein Handbook Reference),
MLS001076132,
MLS001424258,
SPBio_003059,
WLN: T6NJ DVMM2VM1R,
BPBio1_001296,
CHEMBL1256841,
DTXSID1023362,
CHEBI:94510,
CTK8G1845,
BDBM163693,
HMS1571K20,
HMS2052O21,
HMS2089M13,
HMS2093L10,
HMS2098K20,
HMS2233A06,
HMS3262N11,
HMS3372J15,
HMS3394O21,
HMS3715K20,
Pharmakon1600-01505986,
ACM51127,
HY-B1199,
ZINC1713761,
Tox21_110208,
Tox21_500865,
2586AH,
NSC759298,
AKOS003390166,
Tox21_110208_1,
CCG-101150,
CS-4827,
DB04820,
LP00865,
MCULE-7326088210,
NC00400,
NSC-124514,
NSC-759298,
NCGC00015726-01,
NCGC00015726-02,
NCGC00015726-03,
NCGC00015726-04,
NCGC00015726-05,
NCGC00015726-07,
NCGC00015726-08,
NCGC00015726-09,
NCGC00015726-11,
NCGC00022832-03,
NCGC00022832-04,
NCGC00261550-01,
CPD000059131,
LS-84849,
SAM001246861,
SBI-0050840.P002,
AB00384282,
EU-0100865,
FT-0631220,
ST45022574,
SW197230-4,
D07337,
N 1392,
AB00384282-14,
AB00384282_15,
AB00384282_16,
C-18665,
N-benzyl-3-(2-isonicotinoylhydrazinyl)propanamide,
N-Benzyl- beta-[isonicotinyl-hydrazine] propionamide,
N-Benzyl-3-(2-isonicotinoylhydrazino)propanamide #,
N-Benzyl-beta-[isonicotinyl-hydrazine] propionamide,
SR-01000000028-2,
SR-01000000028-5,
SR-01000000028-7,
SR-01000000028-8,
BRD-K12102668-001-04-0,
N-benzyl-3-[(4-pyridylcarbonylamino)amino]propanamide,
2-(2-(Benzylcarbamoyl)ethyl)hydrazide, isonicotinic acid,
N1-.beta.-Benzylcarbamoylethyl-N2-isonicotinoylhydrazine,
Isonicotinic acid, {2-[2-(benzylcarbamoyl)ethyl]hydrazide},
Isonicotinic acid, {2-[2-(benzylcarbamoylethyl]hydrazide},
Isonicotinic acid, 2-[2- (benzylcarbamoyl)ethyl]hydrazide,
N-benzyl-3-[2-(pyridine-4-carbonyl)hydrazino]propanamide,
Pyridine-4-carboxylic 2-[2-(benzylcarbamoyl)ethyl]hydrazide,
3-[[oxo(pyridin-4-yl)methyl]hydrazo]-N-(phenylmethyl)propanamide,
Hydrazine, N-isonicotinoyl-N'-[beta-(N-benzylcarboxamido)ethyl]-,
n(sup1)-.beta.-Benzylcarbamoylethyl-n(sup2)isonicotinoylhydrazine,
N-(phenylmethyl)-3-[2-(pyridin-4-ylcarbonyl)hydrazino]propanamide,
N-Benzyl-3-[N'-(1-pyridin-4-yl-methanoyl)-hydrazino]-propionamide,
N-isonicotinoyl-N [ beta-(N-benzyl-carboxamido) ethyl] hydrazine,
N-isonicotinoyl-N' [ beta-(N-benzyl-carboxamido) ethyl] hydrazine,
4-Pyridinecarboxylic acid, 2-(3-oxo-3-((phenylmethyl)amino)propyl)hydrazide (9CI),
Niamide,
nialamid-,
Nialamide [BAN:INN],
C16H18N4O2,
CID4472,
N-Benzyl-beta-(isonicotinylhydrazino)propionamide,
C16-H18-N4-O2,
D009526,
1-[2-(benzylcarbamoyl)ethyl]-2-isonicotinoylhydrazide,
isonicotinic acid 2-[2-(benzylcarbamoyl)ethyl]hydrazide,
|
| Complexity | 350 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 298.143g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 298.346g/mol |
| Monoisotopic Mass | 298.143g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 83.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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