3-fluoro-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}pyridine-2-carboxamide
Chemical Structure Depiction of
3-fluoro-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}pyridine-2-carboxamide
3-fluoro-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}pyridine-2-carboxamide
Compound characteristics
| Compound ID: | S233-1785 |
| Compound Name: | 3-fluoro-N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}pyridine-2-carboxamide |
| Molecular Weight: | 349.4 |
| Molecular Formula: | C18 H24 F N3 O3 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2CCOC)=O)CNC(c1c(cccn1)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0155 |
| logD: | 1.0155 |
| logSw: | -1.7939 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.354 |
| InChI Key: | GVALCRMGXZAGLO-KDOFPFPSSA-N |