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N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide
TL;DR: N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide (CAS 315671-03-5) is a chemical compound with molecular formula C15H18N2O3 and molecular weight 274.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide
Also Known As: N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide, N-[2-(1-cyclohexen-1-yl)ethyl]-3-nitrobenzamide, BAS 02228053, BIM-0015428.P001, N-[2-(cyclohex-1-en-1-yl)ethyl]-3-nitrobenzamide
| Molecular Formula | C15H18N2O3 |
|---|---|
| Molecular Weight | 274.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.13174 |
| Heavy Atoms | 20 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 315671-03-5 |
|---|---|
| SMILES | C1CCC(=CC1)CCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | ICWIBITZFMNCNM-UHFFFAOYSA-N |
Product Overview
N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide (CAS 315671-03-5), with molecular formula C15H18N2O3 and molecular weight 274.13 g/mol. IUPAC: N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide.
Chemical Property Profile of N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide
Property Insights of N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide
The XLogP value of 3.1 indicates that N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[2-(cyclohexen-1-yl)ethyl]-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-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide?
The CAS number of N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide is 315671-03-5.
What is the molecular formula of N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide?
The molecular formula of N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide is C15H18N2O3.
What is the molecular weight of N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide?
The molecular weight of N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide is 274.13 g/mol.
Where can I buy N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide?
You can request a quote for N-[2-(cyclohexen-1-yl)ethyl]-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-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(cyclohexen-1-yl)ethyl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.