N-(4-cyanophenyl)propanamide
TL;DR: N-(4-cyanophenyl)propanamide (CAS 314764-76-6) 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-(4-cyanophenyl)propanamide
Also Known As: N-(4-cyanophenyl)propanamide, 4-propionylamino-benzonitrile, TimTec1_003098, N-(4-cyanophenyl)propionamide, BRD-K17664146-001-01-2
| Molecular Formula | C10H10N2O |
|---|---|
| Molecular Weight | 174.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 174.07932 |
| Heavy Atoms | 13 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 314764-76-6 |
|---|---|
| SMILES | CCC(=O)NC1=CC=C(C=C1)C#N |
| InChIKey | VFDJCIHJJXJTPQ-UHFFFAOYSA-N |
Product Overview
N-(4-cyanophenyl)propanamide (CAS 314764-76-6), with molecular formula C10H10N2O and molecular weight 174.08 g/mol. IUPAC: N-(4-cyanophenyl)propanamide.
Chemical Property Profile of N-(4-cyanophenyl)propanamide
Property Insights of N-(4-cyanophenyl)propanamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-cyanophenyl)propanamide. With a topological polar surface area (TPSA) of 52.9 Ų, N-(4-cyanophenyl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-cyanophenyl)propanamide 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-(4-cyanophenyl)propanamide?
The CAS number of N-(4-cyanophenyl)propanamide is 314764-76-6.
What is the molecular formula of N-(4-cyanophenyl)propanamide?
The molecular formula of N-(4-cyanophenyl)propanamide is C10H10N2O.
What is the molecular weight of N-(4-cyanophenyl)propanamide?
The molecular weight of N-(4-cyanophenyl)propanamide is 174.08 g/mol.
Where can I buy N-(4-cyanophenyl)propanamide?
You can request a quote for N-(4-cyanophenyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-cyanophenyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-cyanophenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.