Basic information
- Standard SMILES
CC[C@@H](N)C(=O)N1CC(C#N)C1.O=C(O)C(F)(F)F- InChIKey
OOCVVXIWHPPXLK-OGFXRTJISA-N- Molecular formula
- C10H14F3N3O3
- Average molar mass
- 281.23 g/mol
Names & identifiers
- Preferred name
- 1-((R)-2-amino-butyryl)-azetidine-3-carbonitrile trifluoroacetate
- IUPAC
- 1-[(2R)-2-aminobutanoyl]azetidine-3-carbonitrile;2,2,2-trifluoroacetic acid
Names & synonyms
1-((R)-2-amino-butyryl)-azetidine-3-carbonitrile trifluoroacetateSCHEMBL14738473
Database identifiers
- PubChem CID
- 71280452
Properties
Computed structural properties
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 307
Related reactions
1 records
Compound notes
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