n-(Cyanomethyl)-2-phenylacetamide
TL;DR: n-(Cyanomethyl)-2-phenylacetamide (CAS 6327-42-0) is a chemical compound with molecular formula C10H10N2O and molecular weight 174.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyanomethyl)-2-phenylacetamide
Also Known As: Phenaceturonitrile, n-(cyanomethyl)-2-phenylacetamide, Phenacetursaeure-nitril, N-Phenylacetylglycinonitrile, N-Cyanomethylphenylacetamide
| Molecular Formula | C10H10N2O |
|---|---|
| Molecular Weight | 174.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.07932 |
| Heavy Atoms | 13 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 6327-42-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)NCC#N |
| InChIKey | VTGAHHSISUODFE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n-(Cyanomethyl)-2-phenylacetamide (CAS 6327-42-0), with molecular formula C10H10N2O and molecular weight 174.08 g/mol. IUPAC: N-(cyanomethyl)-2-phenylacetamide.
Chemical Property Profile of n-(Cyanomethyl)-2-phenylacetamide
Property Insights of n-(Cyanomethyl)-2-phenylacetamide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-(Cyanomethyl)-2-phenylacetamide. With a topological polar surface area (TPSA) of 52.9 Ų, n-(Cyanomethyl)-2-phenylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-(Cyanomethyl)-2-phenylacetamide 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-(Cyanomethyl)-2-phenylacetamide?
The CAS number of n-(Cyanomethyl)-2-phenylacetamide is 6327-42-0.
What is the molecular formula of n-(Cyanomethyl)-2-phenylacetamide?
The molecular formula of n-(Cyanomethyl)-2-phenylacetamide is C10H10N2O.
What is the molecular weight of n-(Cyanomethyl)-2-phenylacetamide?
The molecular weight of n-(Cyanomethyl)-2-phenylacetamide is 174.08 g/mol.
Where can I buy n-(Cyanomethyl)-2-phenylacetamide?
You can request a quote for n-(Cyanomethyl)-2-phenylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-(Cyanomethyl)-2-phenylacetamide?
Yes, KEHONG BIO provides custom synthesis services for n-(Cyanomethyl)-2-phenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.