Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate
TL;DR: Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate (CAS 1181486-44-1) is a chemical compound with molecular formula C14H16N2O3 and molecular weight 260.1161 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (E)-2-cyano-3-(2-methoxy-5-methylanilino)prop-2-enoate
Also Known As: ethyl 2-cyano-3-[(2-methoxy-5-methylphenyl)amino]prop-2-enoate, ethyl (E)-2-cyano-3-(2-methoxy-5-methylanilino)prop-2-enoate, ethyl2-cyano-3-[(2-methoxy-5-methylphenyl)amino]prop-2-enoate, Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate, 985-632-3
Technical Specifications
| Molecular Formula | C14H16N2O3 |
| Molecular Weight | 260.1161 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 260.1161 Da |
| Heavy Atoms | 19 |
| Complexity | 383.0 |
| SMILES | CCOC(=O)/C(=C/NC1=C(C=CC(=C1)C)OC)/C#N |
| InChIKey | IDXWFKMEKDOMQY-PKNBQFBNSA-N |
Chemical Property Profile of Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate
Property Insights of Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate
The XLogP value of 3.1 indicates that Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate. Following Lipinski's Rule of Five, Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate?
The CAS number of Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate is 1181486-44-1.
What is the molecular formula of Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate?
The molecular formula of Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate is C14H16N2O3.
What is the molecular weight of Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate?
The molecular weight of Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate is 260.1161 g/mol.
Where can I buy Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate?
You can request a quote for Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-cyano-3-((2-methoxy-5-methylphenyl)amino)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.