![2-[Methyl(phenyl)amino]prop-2-enenitrile structure](/static/products/6956/69567-06-2.webp)
2-[Methyl(phenyl)amino]prop-2-enenitrile
TL;DR: 2-[Methyl(phenyl)amino]prop-2-enenitrile (CAS 69567-06-2) is a chemical compound with molecular formula C10H10N2 and molecular weight 158.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(N-methylanilino)prop-2-enenitrile
Also Known As: 2-[Methyl(phenyl)amino]acrylonitrile, 2-(N-methylanilino)prop-2-enenitrile, 2-[Methyl(phenyl)amino]prop-2-enenitrile, 2-[Phenyl(methyl)amino]acrylonitrile, 2-Propenenitrile,2-(methylphenylamino)-
| Molecular Formula | C10H10N2 |
|---|---|
| Molecular Weight | 158.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 158.0844 |
| Heavy Atoms | 12 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 69567-06-2 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=C)C#N |
| InChIKey | WJFCMLXARVNIJC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[Methyl(phenyl)amino]prop-2-enenitrile (CAS 69567-06-2), with molecular formula C10H10N2 and molecular weight 158.08 g/mol. IUPAC: 2-(N-methylanilino)prop-2-enenitrile.
Chemical Property Profile of 2-[Methyl(phenyl)amino]prop-2-enenitrile
Property Insights of 2-[Methyl(phenyl)amino]prop-2-enenitrile
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[Methyl(phenyl)amino]prop-2-enenitrile. With a topological polar surface area (TPSA) of 27.0 Ų, 2-[Methyl(phenyl)amino]prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[Methyl(phenyl)amino]prop-2-enenitrile has 0 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-[Methyl(phenyl)amino]prop-2-enenitrile?
The CAS number of 2-[Methyl(phenyl)amino]prop-2-enenitrile is 69567-06-2.
What is the molecular formula of 2-[Methyl(phenyl)amino]prop-2-enenitrile?
The molecular formula of 2-[Methyl(phenyl)amino]prop-2-enenitrile is C10H10N2.
What is the molecular weight of 2-[Methyl(phenyl)amino]prop-2-enenitrile?
The molecular weight of 2-[Methyl(phenyl)amino]prop-2-enenitrile is 158.08 g/mol.
Where can I buy 2-[Methyl(phenyl)amino]prop-2-enenitrile?
You can request a quote for 2-[Methyl(phenyl)amino]prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Methyl(phenyl)amino]prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[Methyl(phenyl)amino]prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.