Basic information
- Standard SMILES
C[C@H](OC(=O)N[C@H]1CCN(Cc2ccccc2)C1)C(F)(F)F- InChIKey
KPZLOQYMKSORGH-AAEUAGOBSA-N- Molecular formula
- C15H19F3N2O2
- Average molar mass
- 316.32 g/mol
Names & identifiers
- Preferred name
- (2S)-1,1,1-trifluoropropan-2-yl [(3S)-1-benzylpyrrolidin-3-yl]carbamate
- IUPAC
- [(2S)-1,1,1-trifluoropropan-2-yl] N-[(3S)-1-benzylpyrrolidin-3-yl]carbamate
Names & synonyms
(2S)-1,1,1-trifluoropropan-2-yl [(3S)-1-benzylpyrrolidin-3-yl]carbamateSCHEMBL10079956
Database identifiers
- PubChem CID
- 68029098
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 370
Related reactions
2 records
Compound notes
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