Basic information
- Standard SMILES
CCOc1ccc([C@H](CO)NC(=O)[C@H]2C[C@@H]2c2ccccc2)nc1- InChIKey
OPGDAPGMLKZFSN-RYRKJORJSA-N- Molecular formula
- C19H22N2O3
- Average molar mass
- 326.4 g/mol
Names & identifiers
- Preferred name
- (1S,2S)-2-Phenyl-cyclopropanecarboxylic acid [(R)-1-(5-ethoxy-pyrdin-2-yl)-2-hydroxy-ethyl]-amide
- IUPAC
- trans-(1S,2S)-N-[(1R)-1-(5-ethoxy-2-pyridinyl)-2-hydroxyethyl]-2-phenylcyclopropane-1-carboxamide
Names & synonyms
SCHEMBL14550069OPGDAPGMLKZFSN-RYRKJORJSA-N(1S,2S)-2-Phenyl-cyclopropanecarboxylic acid [(R)-1-(5-ethoxy-pyrdin-2-yl)-2-hydroxy-ethyl]-amide(1S,2S)-2-Phenyl-cyclopropanecarboxylic acid [(R)-1-(5-ethoxy-pyridin-2-yl)-2-hydroxy-ethyl]-amide
Database identifiers
- PubChem CID
- 71201958
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 71.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 411
Related reactions
2 records
Compound notes
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