(1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid
TL;DR: (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid (CAS 246514-65-8) is a chemical compound with molecular formula C16H18N2O3 and molecular weight 286.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[2-(4-cyanoanilino)-2-oxoethyl]cyclopentyl]acetic acid
Also Known As: Maybridge3_002128, IDI1_013515, (1-{2-[(4-cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid, 2-[1-[2-(4-cyanoanilino)-2-oxoethyl]cyclopentyl]acetic acid, AS-662/43412899
| Molecular Formula | C16H18N2O3 |
|---|---|
| Molecular Weight | 286.13 g/mol |
| LogP | 2.92198 |
| Topological Polar Surface Area | 90.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.13174 |
| Heavy Atoms | 21 |
| Complexity | 566.18005 |
Chemical Identifiers
| CAS Number | 246514-65-8 |
|---|---|
| SMILES | C1CCC(C1)(CC(=O)NC2=CC=C(C=C2)C#N)CC(=O)O |
Product Overview
(1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid (CAS 246514-65-8), with molecular formula C16H18N2O3 and molecular weight 286.13 g/mol. IUPAC: 2-[1-[2-(4-cyanoanilino)-2-oxoethyl]cyclopentyl]acetic acid.
Chemical Property Profile of (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid
Property Insights of (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid
The XLogP value of 2.92198 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid. The TPSA of 90.19 Ų falls within the moderate polarity range, balancing permeability and solubility for (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid. Following Lipinski's Rule of Five, (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic 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 (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid?
The CAS number of (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid is 246514-65-8.
What is the molecular formula of (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid?
The molecular formula of (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid is C16H18N2O3.
What is the molecular weight of (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid?
The molecular weight of (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid is 286.13 g/mol.
Where can I buy (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid?
You can request a quote for (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (1-{2-[(4-Cyanophenyl)amino]-2-oxoethyl}cyclopentyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.