| CAS Number | 888-19-7 |
| Catalog Number | AG01E7HA(AGN-PC-0JPEPO) |
| Chemical Name | 1-[2-(1H-indol-3-yl)ethyl]pyrrolidin-2-one |
| IUPAC Name | 1-[2-(1H-indol-3-yl)ethyl]pyrrolidin-2-one |
| InChI | InChI=1S/C14H16N2O/c17-14-6-3-8-16(14)9-7-11-10-15-13-5-2-1-4-12(11)13/h1-2,4-5,10,15H,3,6-9H2 |
| InChI Key | HUULIVDXAQTZEE-UHFFFAOYSA-N |
| MDL Number | MFCD30751457 |
| Molecular Formula | C14H16N2O |
| Molecular Weight | 228.2896 |
| NSC Number | 165217 |
| SMILES | O=C1N(CCC2C3=C(C=CC=C3)NC=2)CCC1 |
| Synonyms | 1-[2-(1H-indol-3-yl)ethyl]pyrrolidin-2-one,
888-19-7,
NSC165217,
AC1L6OLA,
SCHEMBL10679736,
DTXSID40304271,
AKOS034060971,
NSC-165217,
1-[2-(1H-Indole-3-yl)ethyl]pyrrolidine-2-one,
CID295642,
|
| Complexity | 292 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.295g/mol |
| Monoisotopic Mass | 228.126g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 36.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number