Cinnamamide, alpha-cyano-3-fluoro-
Basic information
- CAS
100908-62-1- Standard SMILES
N#C/C(=C\c1ccc(F)cc1)C(N)=O- InChIKey
NVGNGLIOIXXMRZ-UHFFFAOYSA-N- Molecular formula
- C10H7FN2O
- Average molar mass
- 190.17 g/mol
- Monoisotopic mass
- 190.05424101
Names & identifiers
- Preferred name
- Cinnamamide, alpha-cyano-3-fluoro-
- IUPAC
- (E)-2-cyano-3-(4-fluorophenyl)prop-2-enamide
- English name
- 2-Cyano-3-(m-fluorophenyl)acrylamide
- Molecular formula
- C10H7FN2O
- Molecular weight
- 190.17
Names & synonyms
CINNAMAMIDE, alpha-CYANO-3-FLUORO-RefChem:1081650100908-62-12-cyano-3-(4-fluorophenyl)prop-2-enamidealpha-Cyano-3-fluorocinnamamide2-cyano-3-(3-fluorophenyl)prop-2-enamide(E)-2-cyano-3-(4-fluorophenyl)prop-2-enamide2-(3-Fluorobenzylidene)-2-cyanoacetamideAcrylamide, 2-cyano-3-(m-fluorophenyl)-(e)-2-cyano-3-(4-fluorophenyl)acrylamideCHEMBL1927351AKOS003246293
Show more names
2-Cyano-3-(m-fluorophenyl)acrylamide2-Cyano-3-(3-fluorophenyl)-2-propenamide2-Propenamide, 2-cyano-3-(3-fluorophenyl)-
Database identifiers
- CAS
100908-62-1- PubChem CID
- 931990
- ChEMBL
CHEMBL1927351- Nikkaji
- J936.990B
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 294
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Compound notes
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