Basic information
- Standard SMILES
CC(=O)N[C@@H](C)c1ccc(N2CC(O)C2)cc1- InChIKey
JAIWLEPJYINXJE-VIFPVBQESA-N- Molecular formula
- C13H18N2O2
- Average molar mass
- 234.29 g/mol
- Monoisotopic mass
- 234.13682782
Names & identifiers
- Preferred name
- (S)-N-{1-[4-(3-Hydroxy-azetidin-1-yl)-phenyl]ethyl}-acetamide
- IUPAC
- N-[(1S)-1-[4-(3-hydroxyazetidin-1-yl)phenyl]ethyl]acetamide
Names & synonyms
SCHEMBL15064655JAIWLEPJYINXJE-VIFPVBQESA-N(S)-N-{1-[4-(3-Hydroxy-azetidin-1-yl)-phenyl]-ethyl}-acetamide(S)-N-{1-[4-(3-Hydroxy-azetidin-1-yl)-phenyl]ethyl}-acetamide
Database identifiers
- PubChem CID
- 86689005
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 269
Related reactions
6 records
Compound notes
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