Cinnamamide, N-antipyrinyl-
Basic information
- CAS
88828-47-1- Standard SMILES
Cc1c(NC(=O)/C=C/c2ccccc2)c(=O)n(-c2ccccc2)n1C- InChIKey
YRMVEYWFVDONFK-BUHFOSPRSA-N- Molecular formula
- C20H19N3O2
- Average molar mass
- 333.4 g/mol
- Monoisotopic mass
- 333.14772686
Names & identifiers
- Preferred name
- Cinnamamide, N-antipyrinyl-
- IUPAC
- (E)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-phenylprop-2-enamide
Names & synonyms
CINNAMAMIDE, N-ANTIPYRINYL-88828-47-1RefChem:1081713ZINC207279N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-phenylacrylamideN-AntipyrinylcinnamamideBRN 06248571-Phenyl-2,3-dimethyl-4-cinnamoylamino-5-pyrazoloneCINNAMAMIDENANTIPYRINYLNANTIPYRINYLCINNAMAMIDEHMS658E08SMSF0005967
Show more names
MFCD00469646STK018933ZINC00207279(E)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-phenylprop-2-enamideAKOS000580739CB14773BIM-0011560.P001ZINC000000207279
Database identifiers
- CAS
88828-47-1- PubChem CID
- 754050
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 52.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 569
Related reactions
0 records
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Compound notes
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