N-(3-cyanophenyl)acetamide
TL;DR: N-(3-cyanophenyl)acetamide (CAS 58202-84-9) is a chemical compound with molecular formula C9H8N2O and molecular weight 160.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyanophenyl)acetamide
Also Known As: N-(3-cyanophenyl)acetamide, 3'-Cyanoacetanilide, 3-Acetamidobenzonitrile, 3-Acetaminobenzonitril, acetamide, N-(3-cyanophenyl)-
| Molecular Formula | C9H8N2O |
|---|---|
| Molecular Weight | 160.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.06366 |
| Heavy Atoms | 12 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 58202-84-9 |
|---|---|
| SMILES | CC(=O)NC1=CC=CC(=C1)C#N |
| InChIKey | KXBIARKNAZXRGC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(3-cyanophenyl)acetamide (CAS 58202-84-9), with molecular formula C9H8N2O and molecular weight 160.06 g/mol. IUPAC: N-(3-cyanophenyl)acetamide.
Chemical Property Profile of N-(3-cyanophenyl)acetamide
Property Insights of N-(3-cyanophenyl)acetamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-cyanophenyl)acetamide. With a topological polar surface area (TPSA) of 52.9 Ų, N-(3-cyanophenyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-cyanophenyl)acetamide has 1 hydrogen bond donor(s) and 2 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-(3-cyanophenyl)acetamide?
The CAS number of N-(3-cyanophenyl)acetamide is 58202-84-9.
What is the molecular formula of N-(3-cyanophenyl)acetamide?
The molecular formula of N-(3-cyanophenyl)acetamide is C9H8N2O.
What is the molecular weight of N-(3-cyanophenyl)acetamide?
The molecular weight of N-(3-cyanophenyl)acetamide is 160.06 g/mol.
Where can I buy N-(3-cyanophenyl)acetamide?
You can request a quote for N-(3-cyanophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-cyanophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyanophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.