Basic information
- Standard SMILES
CCOC(=O)C(C#N)=CNc1ccc(-c2ccccc2)cn1- InChIKey
GBGVKPSOOLPAIH-UHFFFAOYSA-N- Molecular formula
- C17H15N3O2
- Average molar mass
- 293.32 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-cyano-3-(5-phenyl-2-pyridylamino)acrylate
- IUPAC
- ethyl 2-cyano-3-[(5-phenyl-2-pyridinyl)amino]prop-2-enoate
Names & synonyms
SCHEMBL11472059GBGVKPSOOLPAIH-UHFFFAOYSA-Nethyl 2-cyano-3-(5-phenyl-2-pyridylamino)acrylate
Database identifiers
- PubChem CID
- 70592147
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 75 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 446
Related reactions
3 records
Compound notes
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