Basic information
- Standard SMILES
CN(C)C(=O)Cc1ccc(NC(=O)/C=C/c2cnn(C)c2-c2ccc(F)cc2)cc1- InChIKey
IDOOCPSHOGVPCC-MDWZMJQESA-N- Molecular formula
- C23H23FN4O2
- Average molar mass
- 406.5 g/mol
Names & identifiers
- Preferred name
- (2E)-N-{4-[2-(dimethylamino)-2-oxoethyl]phenyl}-3-[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-4-yl]acrylamide
- IUPAC
- (E)-N-[4-[2-(dimethylamino)-2-oxoethyl]phenyl]-3-[5-(4-fluorophenyl)-1-methylpyrazol-4-yl]prop-2-enamide
Names & synonyms
SCHEMBL4836278IDOOCPSHOGVPCC-MDWZMJQESA-N(2E)-N-{4-[2-(dimethylamino)-2-oxoethyl]phenyl}-3-[5-(4-fluorophenyl)-1-methyl-1H-pyrazol-4-yl]acrylamide
Database identifiers
- PubChem CID
- 69210280
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 610
Related reactions
1 records
Compound notes
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