Basic information
- Standard SMILES
CCCC(NC(c1ccc(-c2ccc(C(C)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1- InChIKey
XFOHYZCSPCLKDU-UHFFFAOYSA-N- Molecular formula
- C25H26F3N3O2
- Average molar mass
- 457.5 g/mol
- Monoisotopic mass
- 457.19771157
Names & identifiers
- IUPAC
- 2-[[1-[4-(4-acetylphenyl)phenyl]-2,2,2-trifluoroethyl]amino]-N-(1-cyanocyclopropyl)pentanamide
Database identifiers
- PubChem CID
- 72365987
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 82 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 740
Related reactions
1 records
Compound notes
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