Basic information
- Standard SMILES
COc1ccc(/C=C/C(=O)Nc2ccn(CCCCC(C)(F)F)n2)cc1- InChIKey
TYCYLCXMQUPUMH-JXMROGBWSA-N- Molecular formula
- C19H23F2N3O2
- Average molar mass
- 363.4 g/mol
Names & identifiers
- Preferred name
- (E)-N-[1-(5,5-Difluoro-hexyl)-1H-pyrazol-3-yl]-3-(4-methoxy-phenyl)-acrylamide
- IUPAC
- (E)-N-[1-(5,5-difluorohexyl)pyrazol-3-yl]-3-(4-methoxyphenyl)prop-2-enamide
Names & synonyms
(E)-N-[1-(5,5-Difluoro-hexyl)-1H-pyrazol-3-yl]-3-(4-methoxy-phenyl)-acrylamideSCHEMBL1167932
Database identifiers
- PubChem CID
- 66929501
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 56.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 466
Related reactions
1 records
Compound notes
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