3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile
TL;DR: 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile (CAS 1025649-82-4) is a chemical compound with molecular formula C17H21N3O2 and molecular weight 299.1634 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[4-(N-methoxy-C-methylcarbonimidoyl)anilino]methylidene]-4,4-dimethyl-3-oxopentanenitrile
Also Known As: 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile, 2-[[4-(N-methoxy-C-methyl-carbonimidoyl)anilino]methylene]-4,4-dimethyl-3-oxo-pentanenitrile, 2-[[4-(N-methoxy-C-methylcarbonimidoyl)anilino]methylidene]-4,4-dimethyl-3-oxopentanenitrile
Technical Specifications
| Molecular Formula | C17H21N3O2 |
| Molecular Weight | 299.1634 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 74.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 299.1634 Da |
| Heavy Atoms | 22 |
| Complexity | 498.0 |
| SMILES | CC(=NOC)C1=CC=C(C=C1)NC=C(C#N)C(=O)C(C)(C)C |
| InChIKey | QEFLWSHVWFYXGF-UHFFFAOYSA-N |
Chemical Property Profile of 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile
Property Insights of 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile
The XLogP value of 3.9 indicates that 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile. Following Lipinski's Rule of Five, 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile 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 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile?
The CAS number of 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile is 1025649-82-4.
What is the molecular formula of 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile?
The molecular formula of 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile is C17H21N3O2.
What is the molecular weight of 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile?
The molecular weight of 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile is 299.1634 g/mol.
Where can I buy 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile?
You can request a quote for 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile?
Yes, CoreyChem provides custom synthesis services for 3-((4-(2-aza-2-methoxy-1-methylvinyl)phenyl)amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.