N-(2-methylpropyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Chemical Structure Depiction of
N-(2-methylpropyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
N-(2-methylpropyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Compound characteristics
| Compound ID: | S534-0221 |
| Compound Name: | N-(2-methylpropyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide |
| Molecular Weight: | 281.44 |
| Molecular Formula: | C16 H31 N3 O |
| Smiles: | CC(C)CNC(N1CCCCCC1CN1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6004 |
| logD: | -0.8702 |
| logSw: | -2.7422 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.377 |
| InChI Key: | KLUJYLCQVBAAEC-OAHLLOKOSA-N |