N-[1-(3-methylbenzoyl)pyrrolidin-3-yl]but-2-ynamide
Chemical Structure Depiction of
N-[1-(3-methylbenzoyl)pyrrolidin-3-yl]but-2-ynamide
N-[1-(3-methylbenzoyl)pyrrolidin-3-yl]but-2-ynamide
Compound characteristics
| Compound ID: | T002-1796 |
| Compound Name: | N-[1-(3-methylbenzoyl)pyrrolidin-3-yl]but-2-ynamide |
| Molecular Weight: | 270.33 |
| Molecular Formula: | C16 H18 N2 O2 |
| Smiles: | CC#CC(NC1CCN(C1)C(c1cccc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.867 |
| logD: | 1.867 |
| logSw: | -2.2668 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.191 |
| InChI Key: | ZOVCLHSZIDJASB-AWEZNQCLSA-N |