Basic information
- Standard SMILES
N[C@H]1CCCC[C@H]1NC(=O)C(F)(F)F- InChIKey
VYRJWQVTRKFSII-NTSWFWBYSA-N- Molecular formula
- C8H13F3N2O
- Average molar mass
- 210.2 g/mol
- Monoisotopic mass
- 210.09799753
Names & identifiers
- Preferred name
- Acetamide, N-(2-aminocyclohexyl)-2,2,2-trifluoro-, cis-
- IUPAC
- N-[(1R,2S)-2-aminocyclohexyl]-2,2,2-trifluoroacetamide
Names & synonyms
Acetamide, N-(2-aminocyclohexyl)-2,2,2-trifluoro-, cis-SCHEMBL1987297cis-N-(2-Aminocyclohexyl)-2,2,2-trifluoroacetamide
Database identifiers
- PubChem CID
- 11042018
- Nikkaji
- J3.642.530J
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 217
Related reactions
4 records
Compound notes
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