N-(cyclohexylmethyl)-3-nitrobenzamide
TL;DR: N-(cyclohexylmethyl)-3-nitrobenzamide (CAS 881589-86-2) is a chemical compound with molecular formula C14H18N2O3 and molecular weight 262.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyclohexylmethyl)-3-nitrobenzamide
Also Known As: N-(cyclohexylmethyl)-3-nitrobenzamide, N-(cyclohexylmethyl)(3-nitrophenyl)carboxamide
| Molecular Formula | C14H18N2O3 |
|---|---|
| Molecular Weight | 262.13 g/mol |
| LogP | 2.9049 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.13174 |
| Heavy Atoms | 19 |
| Complexity | 467.51382 |
Chemical Identifiers
| CAS Number | 881589-86-2 |
|---|---|
| SMILES | C1CCC(CC1)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
N-(cyclohexylmethyl)-3-nitrobenzamide (CAS 881589-86-2), with molecular formula C14H18N2O3 and molecular weight 262.13 g/mol. IUPAC: N-(cyclohexylmethyl)-3-nitrobenzamide.
Chemical Property Profile of N-(cyclohexylmethyl)-3-nitrobenzamide
Property Insights of N-(cyclohexylmethyl)-3-nitrobenzamide
The XLogP value of 2.9049 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(cyclohexylmethyl)-3-nitrobenzamide. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(cyclohexylmethyl)-3-nitrobenzamide. Following Lipinski's Rule of Five, N-(cyclohexylmethyl)-3-nitrobenzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(cyclohexylmethyl)-3-nitrobenzamide?
The CAS number of N-(cyclohexylmethyl)-3-nitrobenzamide is 881589-86-2.
What is the molecular formula of N-(cyclohexylmethyl)-3-nitrobenzamide?
The molecular formula of N-(cyclohexylmethyl)-3-nitrobenzamide is C14H18N2O3.
What is the molecular weight of N-(cyclohexylmethyl)-3-nitrobenzamide?
The molecular weight of N-(cyclohexylmethyl)-3-nitrobenzamide is 262.13 g/mol.
Where can I buy N-(cyclohexylmethyl)-3-nitrobenzamide?
You can request a quote for N-(cyclohexylmethyl)-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(cyclohexylmethyl)-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(cyclohexylmethyl)-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.