N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}-3-methylbutanamide
Chemical Structure Depiction of
N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}-3-methylbutanamide
N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}-3-methylbutanamide
Compound characteristics
| Compound ID: | M626-0742 |
| Compound Name: | N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}-3-methylbutanamide |
| Molecular Weight: | 289.42 |
| Molecular Formula: | C17 H27 N3 O |
| Smiles: | CC(C)CC(NCc1ccc(nc1)N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4768 |
| logD: | 3.4678 |
| logSw: | -3.3727 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.094 |
| InChI Key: | NOKGAYVZMDQQDJ-UHFFFAOYSA-N |