Basic information
- Standard SMILES
Nc1cccc(CNC(=O)C(F)(F)F)c1- InChIKey
HTCDSUBGQCAFOY-UHFFFAOYSA-N- Molecular formula
- C9H9F3N2O
- Average molar mass
- 218.18 g/mol
Names & identifiers
- Preferred name
- N-(3-aminobenzyl)-2,2,2-trifluoroacetamide
- IUPAC
- N-[(3-aminophenyl)methyl]-2,2,2-trifluoroacetamide
Names & synonyms
N-(3-aminobenzyl)-2,2,2-trifluoroacetamide3-TrifluoracetamidometylanilineSCHEMBL2252763N-(3-amino-benzyl)-2,2,2-trifluoro-acetamideN-[(3-aminophenyl)methyl]-2,2,2-trifluoroacetamide
Database identifiers
- PubChem CID
- 21131928
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 230
Related reactions
6 records
Compound notes
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