2-cyano-3-(4-methylphenyl)prop-2-enamide
TL;DR: 2-cyano-3-(4-methylphenyl)prop-2-enamide (CAS 52287-59-9) is a chemical compound with molecular formula C11H10N2O and molecular weight 186.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-3-(4-methylphenyl)prop-2-enamide
Also Known As: 2-cyano-3-(4-methylphenyl)prop-2-enamide, 2-Cyano-3-(p-tolyl)acrylamide, (2E)-2-cyano-3-(4-methylphenyl)acrylamide
| Molecular Formula | C11H10N2O |
|---|---|
| Molecular Weight | 186.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.07932 |
| Heavy Atoms | 14 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 52287-59-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C=C(C#N)C(=O)N |
| InChIKey | GKITYBHTVPXXMR-UHFFFAOYSA-N |
Product Overview
2-cyano-3-(4-methylphenyl)prop-2-enamide (CAS 52287-59-9), with molecular formula C11H10N2O and molecular weight 186.08 g/mol. IUPAC: 2-cyano-3-(4-methylphenyl)prop-2-enamide.
Chemical Property Profile of 2-cyano-3-(4-methylphenyl)prop-2-enamide
Property Insights of 2-cyano-3-(4-methylphenyl)prop-2-enamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-cyano-3-(4-methylphenyl)prop-2-enamide. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-3-(4-methylphenyl)prop-2-enamide. Following Lipinski's Rule of Five, 2-cyano-3-(4-methylphenyl)prop-2-enamide 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 2-cyano-3-(4-methylphenyl)prop-2-enamide?
The CAS number of 2-cyano-3-(4-methylphenyl)prop-2-enamide is 52287-59-9.
What is the molecular formula of 2-cyano-3-(4-methylphenyl)prop-2-enamide?
The molecular formula of 2-cyano-3-(4-methylphenyl)prop-2-enamide is C11H10N2O.
What is the molecular weight of 2-cyano-3-(4-methylphenyl)prop-2-enamide?
The molecular weight of 2-cyano-3-(4-methylphenyl)prop-2-enamide is 186.08 g/mol.
Where can I buy 2-cyano-3-(4-methylphenyl)prop-2-enamide?
You can request a quote for 2-cyano-3-(4-methylphenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-3-(4-methylphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-3-(4-methylphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.