4-cyano-N-cyclohexylbenzamide
TL;DR: 4-cyano-N-cyclohexylbenzamide (CAS 167762-78-9) is a chemical compound with molecular formula C14H16N2O and molecular weight 228.12627 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-cyano-N-cyclohexylbenzamide
Also Known As: 4-cyano-N-cyclohexylbenzamide, 4-cyano-N-cyclohexyl-benzamide, N-Cyclohexyl-4-cyanobenzamide, (4-cyanophenyl)-N-cyclohexylcarboxamide, J2.879.071F
Technical Specifications
| Molecular Formula | C14H16N2O |
| Molecular Weight | 228.12627 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.12627 Da |
| Heavy Atoms | 17 |
| Complexity | 303.0 |
| SMILES | C1CCC(CC1)NC(=O)C2=CC=C(C=C2)C#N |
| InChIKey | FIJFRMGCAGJLAQ-UHFFFAOYSA-N |
Chemical Property Profile of 4-cyano-N-cyclohexylbenzamide
Property Insights of 4-cyano-N-cyclohexylbenzamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-cyano-N-cyclohexylbenzamide. With a topological polar surface area (TPSA) of 52.9 Ų, 4-cyano-N-cyclohexylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-cyano-N-cyclohexylbenzamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-cyano-N-cyclohexylbenzamide?
The CAS number of 4-cyano-N-cyclohexylbenzamide is 167762-78-9.
What is the molecular formula of 4-cyano-N-cyclohexylbenzamide?
The molecular formula of 4-cyano-N-cyclohexylbenzamide is C14H16N2O.
What is the molecular weight of 4-cyano-N-cyclohexylbenzamide?
The molecular weight of 4-cyano-N-cyclohexylbenzamide is 228.12627 g/mol.
Where can I buy 4-cyano-N-cyclohexylbenzamide?
You can request a quote for 4-cyano-N-cyclohexylbenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-cyano-N-cyclohexylbenzamide?
Yes, CoreyChem provides custom synthesis services for 4-cyano-N-cyclohexylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.