Basic information
- Standard SMILES
CC(=O)N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1cc(C(F)(F)F)ccc1N- InChIKey
IMBJOXLKUHZEFL-UHFFFAOYSA-N- Molecular formula
- C19H15F9N2O
- Average molar mass
- 458.3 g/mol
Names & identifiers
- Preferred name
- N-[2-amino-5-(trifluoromethyl)benzyl]-N-[3,5-bis(trifluoromethyl)benzyl]-acetamide
- IUPAC
- N-[[2-amino-5-(trifluoromethyl)phenyl]methyl]-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]acetamide
Names & synonyms
N-[2-amino-5-(trifluoromethyl)benzyl]-N-[3,5-bis(trifluoromethyl)benzyl]-acetamideSCHEMBL3557612
Database identifiers
- PubChem CID
- 86615399
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 595
Related reactions
3 records
Compound notes
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