N-[(1S,2S,5R)-1-(3-Aza-bicyclo[3.1.0]hex-2-yl)methyl]-2,2,2-trifluoro-acetamide
Basic information
- Standard SMILES
O=C(NC[C@H]1NC[C@@H]2C[C@@H]21)C(F)(F)F- InChIKey
FVKWMTMGFITNOT-HCWXCVPCSA-N- Molecular formula
- C8H11F3N2O
- Average molar mass
- 208.18 g/mol
Names & identifiers
- Preferred name
- N-[(1S,2S,5R)-1-(3-Aza-bicyclo[3.1.0]hex-2-yl)methyl]-2,2,2-trifluoro-acetamide
- IUPAC
- N-[[(1S,2S,5R)-3-azabicyclo[3.1.0]hexan-2-yl]methyl]-2,2,2-trifluoroacetamide
Names & synonyms
N-[(1S,2S,5R)-1-(3-Aza-bicyclo[3.1.0]hex-2-yl)methyl]-2,2,2-trifluoro-acetamideSCHEMBL1340003
Database identifiers
- PubChem CID
- 59444331
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 253
Related reactions
6 records
Compound notes
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