3a,6a-dimethylhexahydro-1,4-methanocyclopenta[c]pyrrole-1(2H)-carbonitrile
Chemical Structure Depiction of
3a,6a-dimethylhexahydro-1,4-methanocyclopenta[c]pyrrole-1(2H)-carbonitrile
3a,6a-dimethylhexahydro-1,4-methanocyclopenta[c]pyrrole-1(2H)-carbonitrile
Compound characteristics
| Compound ID: | 8016-5446 |
| Compound Name: | 3a,6a-dimethylhexahydro-1,4-methanocyclopenta[c]pyrrole-1(2H)-carbonitrile |
| Molecular Weight: | 176.26 |
| Molecular Formula: | C11 H16 N2 |
| Smiles: | CC12CNC3(CC1CCC23C)C#N |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9085 |
| logD: | 1.8546 |
| logSw: | -2.2307 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.9224 |
| InChI Key: | VTWMQWOGTQTYKI-UHFFFAOYSA-N |