3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-azabicyclo[2.2.2]octane-3-carbonitrile
Chemical Structure Depiction of
3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-azabicyclo[2.2.2]octane-3-carbonitrile
3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-azabicyclo[2.2.2]octane-3-carbonitrile
Compound characteristics
| Compound ID: | 8018-4246 |
| Compound Name: | 3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-azabicyclo[2.2.2]octane-3-carbonitrile |
| Molecular Weight: | 315.41 |
| Molecular Formula: | C18 H25 N3 O2 |
| Smiles: | COc1ccc(CCNC2(CN3CCC2CC3)C#N)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3697 |
| logD: | 1.3428 |
| logSw: | -2.1205 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.486 |
| InChI Key: | XCICRKYWHHRREI-SFHVURJKSA-N |