n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide
TL;DR: n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide (CAS 875863-80-2) is a chemical compound with molecular formula C11H12FN3O and molecular weight 221.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(2-cyano-3-fluoroanilino)ethyl]acetamide
Also Known As: n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide
| Molecular Formula | C11H12FN3O |
|---|---|
| Molecular Weight | 221.10 g/mol |
| LogP | 1.24538 |
| Topological Polar Surface Area | 64.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.09644 |
| Heavy Atoms | 16 |
| Complexity | 425.72812 |
Chemical Identifiers
| CAS Number | 875863-80-2 |
|---|---|
| SMILES | CC(=O)NCCNC1=C(C(=CC=C1)F)C#N |
Product Overview
n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide (CAS 875863-80-2), with molecular formula C11H12FN3O and molecular weight 221.10 g/mol. IUPAC: N-[2-(2-cyano-3-fluoroanilino)ethyl]acetamide.
Chemical Property Profile of n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide
Property Insights of n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide
The XLogP value of 1.24538 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide. The TPSA of 64.92 Ų falls within the moderate polarity range, balancing permeability and solubility for n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide. Following Lipinski's Rule of Five, n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide has 2 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-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide?
The CAS number of n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide is 875863-80-2.
What is the molecular formula of n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide?
The molecular formula of n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide is C11H12FN3O.
What is the molecular weight of n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide?
The molecular weight of n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide is 221.10 g/mol.
Where can I buy n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide?
You can request a quote for n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for n-(2-((2-Cyano-3-fluorophenyl)amino)ethyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.