Basic information
- Standard SMILES
CCC(C)[C@H](N)C(=O)N1CC(F)(F)C1.Cl- InChIKey
VXYKWFLKCIJOCB-JWOPXBRZSA-N- Molecular formula
- C9H17ClF2N2O
- Average molar mass
- 242.69 g/mol
Names & identifiers
- Preferred name
- (S)-2-amino-1-(3,3-difluoro-azetidin-1-yl)-3-methyl-pentan-1-one hydrochloride
- IUPAC
- (2S)-2-amino-1-(3,3-difluoroazetidin-1-yl)-3-methylpentan-1-one;hydrochloride
Names & synonyms
(S)-2-amino-1-(3,3-difluoro-azetidin-1-yl)-3-methyl-pentan-1-one hydrochlorideSCHEMBL6229431
Database identifiers
- PubChem CID
- 69713143
Properties
Computed structural properties
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 225
Related reactions
1 records
Compound notes
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