HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-cyano-N-(4-methylbenzyl)benzamide

Identifiers & Physical Properties
| Molecular formula | C16H14N2O |
|---|---|
| Average molar mass | 250.29 g/mol |
| Monoisotopic mass | 250.11061307 g/mol |
| SMILES | Cc1ccc(CNC(=O)c2ccc(C#N)cc2)cc1 |
| InChIKey | DQIGYSGPNHOHLV-UHFFFAOYSA-N |
| PubChem CID | 5040887 |
Chemical & Physical Properties
| XLogP | 2.3 |
|---|---|
| Topological polar surface area | 52.9 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 3 |
| Heavy atoms | 19 |
| Formal charge | 0 |
| Complexity | 341 |