N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide
TL;DR: N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide (CAS 349396-31-2) is a chemical compound with molecular formula C16H22N2O3 and molecular weight 290.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide
Also Known As: N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide, BIM-0018439.P001, N-cyclohexyl-N-ethyl(2-methyl-3-nitrophenyl)carboxamide
| Molecular Formula | C16H22N2O3 |
|---|---|
| Molecular Weight | 290.16 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.16306 |
| Heavy Atoms | 21 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 349396-31-2 |
|---|---|
| SMILES | CCN(C1CCCCC1)C(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C |
| InChIKey | LSQZYSPNOMIWKI-UHFFFAOYSA-N |
Product Overview
N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide (CAS 349396-31-2), with molecular formula C16H22N2O3 and molecular weight 290.16 g/mol. IUPAC: N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide.
Chemical Property Profile of N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide
Property Insights of N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide
The XLogP value of 3.8 indicates that N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide. Following Lipinski's Rule of Five, N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide has 0 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-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide?
The CAS number of N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide is 349396-31-2.
What is the molecular formula of N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide?
The molecular formula of N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide is C16H22N2O3.
What is the molecular weight of N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide?
The molecular weight of N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide is 290.16 g/mol.
Where can I buy N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide?
You can request a quote for N-cyclohexyl-N-ethyl-2-methyl-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-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclohexyl-N-ethyl-2-methyl-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.