2-(2-Methoxyanilino)-2-phenylacetonitrile
TL;DR: 2-(2-Methoxyanilino)-2-phenylacetonitrile (CAS 60561-59-3) is a chemical compound with molecular formula C15H14N2O and molecular weight 238.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methoxyanilino)-2-phenylacetonitrile
Also Known As: 2-(2-methoxyanilino)-2-phenylacetonitrile, (2-Methoxyanilino)(phenyl)acetonitrile, (2-Methoxyphenylamino)phenylacetonitrile, 2-(2-Methoxyphenylamino)-2-phenylacetonitrile, J2.051.565A
| Molecular Formula | C15H14N2O |
|---|---|
| Molecular Weight | 238.11 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 45.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.11061 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 60561-59-3 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(C#N)C2=CC=CC=C2 |
| InChIKey | CQIQVPIIDUCAME-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Methoxyanilino)-2-phenylacetonitrile (CAS 60561-59-3), with molecular formula C15H14N2O and molecular weight 238.11 g/mol. IUPAC: 2-(2-methoxyanilino)-2-phenylacetonitrile.
Chemical Property Profile of 2-(2-Methoxyanilino)-2-phenylacetonitrile
Property Insights of 2-(2-Methoxyanilino)-2-phenylacetonitrile
The XLogP value of 3.4 indicates that 2-(2-Methoxyanilino)-2-phenylacetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.1 Ų, 2-(2-Methoxyanilino)-2-phenylacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Methoxyanilino)-2-phenylacetonitrile has 1 hydrogen bond donor(s) and 3 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-(2-Methoxyanilino)-2-phenylacetonitrile?
The CAS number of 2-(2-Methoxyanilino)-2-phenylacetonitrile is 60561-59-3.
What is the molecular formula of 2-(2-Methoxyanilino)-2-phenylacetonitrile?
The molecular formula of 2-(2-Methoxyanilino)-2-phenylacetonitrile is C15H14N2O.
What is the molecular weight of 2-(2-Methoxyanilino)-2-phenylacetonitrile?
The molecular weight of 2-(2-Methoxyanilino)-2-phenylacetonitrile is 238.11 g/mol.
Where can I buy 2-(2-Methoxyanilino)-2-phenylacetonitrile?
You can request a quote for 2-(2-Methoxyanilino)-2-phenylacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methoxyanilino)-2-phenylacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methoxyanilino)-2-phenylacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.