2,5-dimethyl-1-phenyl-1H-pyrrole-3-carbonitrile
Chemical Structure Depiction of
2,5-dimethyl-1-phenyl-1H-pyrrole-3-carbonitrile
2,5-dimethyl-1-phenyl-1H-pyrrole-3-carbonitrile
Compound characteristics
| Compound ID: | C799-0737 |
| Compound Name: | 2,5-dimethyl-1-phenyl-1H-pyrrole-3-carbonitrile |
| Molecular Weight: | 196.25 |
| Molecular Formula: | C13 H12 N2 |
| Smiles: | Cc1cc(C#N)c(C)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5482 |
| logD: | 2.5482 |
| logSw: | -2.7607 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 19.9595 |
| InChI Key: | CDDGPEUBNFMYMZ-UHFFFAOYSA-N |