![3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid structure](/static/products/226/22613-66-7.png)
3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid
TL;DR: 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid (CAS 22613-66-7) is a chemical compound with molecular formula C14H12N2O2 and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-cyanoethylamino)naphthalene-2-carboxylic acid
Also Known As: BAS 00341164, 3-[(2-cyanoethyl)amino]-2-naphthoic acid, BIM-0015341.P001, 3-((2-cyanoethyl)amino)-2-naphthoic acid, 3-[(2-cyanoethyl)amino]naphthalene-2-carboxylic acid
| Molecular Formula | C14H12N2O2 |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 2.86358 |
| Topological Polar Surface Area | 73.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.08987 |
| Heavy Atoms | 18 |
| Complexity | 629.21686 |
Chemical Identifiers
| CAS Number | 22613-66-7 |
|---|---|
| SMILES | C1=CC=C2C=C(C(=CC2=C1)C(=O)O)NCCC#N |
Product Overview
3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid (CAS 22613-66-7), with molecular formula C14H12N2O2 and molecular weight 240.09 g/mol. IUPAC: 3-(2-cyanoethylamino)naphthalene-2-carboxylic acid.
Chemical Property Profile of 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid
Property Insights of 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid
The XLogP value of 2.86358 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid. The TPSA of 73.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid. Following Lipinski's Rule of Five, 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid 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 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid?
The CAS number of 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid is 22613-66-7.
What is the molecular formula of 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid?
The molecular formula of 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid is C14H12N2O2.
What is the molecular weight of 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid?
The molecular weight of 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid is 240.09 g/mol.
Where can I buy 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid?
You can request a quote for 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2-Cyanoethyl)amino]naphthalene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.