4-[(2-oxopyrrolidin-1-yl)methyl]benzonitrile
Chemical Structure Depiction of
4-[(2-oxopyrrolidin-1-yl)methyl]benzonitrile
4-[(2-oxopyrrolidin-1-yl)methyl]benzonitrile
Compound characteristics
| Compound ID: | S291-0054 |
| Compound Name: | 4-[(2-oxopyrrolidin-1-yl)methyl]benzonitrile |
| Molecular Weight: | 200.24 |
| Molecular Formula: | C12 H12 N2 O |
| Smiles: | C1CC(N(C1)Cc1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7363 |
| logD: | 0.7363 |
| logSw: | -1.5012 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 34.557 |
| InChI Key: | POQNPHZRRVBLRC-UHFFFAOYSA-N |