N-cyclopentyl-3-nitrobenzamide
TL;DR: N-cyclopentyl-3-nitrobenzamide (CAS 331435-53-1) is a chemical compound with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclopentyl-3-nitrobenzamide
Also Known As: N-cyclopentyl-3-nitrobenzamide, N-Cyclopentyl-3-nitro-benzamide, BAS 00407577
| Molecular Formula | C12H14N2O3 |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 2.2672 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.10045 |
| Heavy Atoms | 17 |
| Complexity | 439.1318 |
Chemical Identifiers
| CAS Number | 331435-53-1 |
|---|---|
| SMILES | C1CCC(C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
N-cyclopentyl-3-nitrobenzamide (CAS 331435-53-1), with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol. IUPAC: N-cyclopentyl-3-nitrobenzamide.
Chemical Property Profile of N-cyclopentyl-3-nitrobenzamide
Property Insights of N-cyclopentyl-3-nitrobenzamide
The XLogP value of 2.2672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-cyclopentyl-3-nitrobenzamide. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cyclopentyl-3-nitrobenzamide. Following Lipinski's Rule of Five, N-cyclopentyl-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-cyclopentyl-3-nitrobenzamide?
The CAS number of N-cyclopentyl-3-nitrobenzamide is 331435-53-1.
What is the molecular formula of N-cyclopentyl-3-nitrobenzamide?
The molecular formula of N-cyclopentyl-3-nitrobenzamide is C12H14N2O3.
What is the molecular weight of N-cyclopentyl-3-nitrobenzamide?
The molecular weight of N-cyclopentyl-3-nitrobenzamide is 234.10 g/mol.
Where can I buy N-cyclopentyl-3-nitrobenzamide?
You can request a quote for N-cyclopentyl-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-cyclopentyl-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclopentyl-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.