| CAS Number | 194036-40-3 |
| Catalog Number | AG019WC3(AGN-PC-00H1Y3) |
| Chemical Name | 7-Ethyl-3-(piperidin-4-yl)-1H-indole |
| IUPAC Name | 7-ethyl-3-piperidin-4-yl-1H-indole |
| InChI | InChI=1S/C15H20N2/c1-2-11-4-3-5-13-14(10-17-15(11)13)12-6-8-16-9-7-12/h3-5,10,12,16-17H,2,6-9H2,1H3 |
| InChI Key | UNCXOQBRFONUFS-UHFFFAOYSA-N |
| MDL Number | MFCD11212310 |
| Molecular Formula | C15H20N2 |
| Molecular Weight | 228.3327 |
| SMILES | CCC1=C2C(C(C3CCNCC3)=CN2)=CC=C1 |
| Synonyms | 7-ethyl-3-(piperidin-4-yl)-1H-indole,
194036-40-3,
7-ethyl-3-(4-piperidinyl)-1H-Indole,
AC1Q2T7D,
SCHEMBL8723523,
CTK6D2169,
ZINC36379753,
AKOS008124766,
MCULE-7562364258,
NE15133,
DA-08683,
FT-0725250,
EN300-51410,
AB00996114-01,
7-ethyl-3-(4-piperidyl)-1H-indole,
CID11831189,
92O,
|
| Complexity | 247 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.339g/mol |
| Monoisotopic Mass | 228.163g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 27.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number