Basic information
- Standard SMILES
CCOc1ccccc1O[C@@H]1CCCN(c2ccc(C(=O)O)cn2)C1- InChIKey
DXKAKSJGIPAFRC-OAHLLOKOSA-N- Molecular formula
- C19H22N2O4
- Average molar mass
- 342.4 g/mol
- Monoisotopic mass
- 342.15795719
Names & identifiers
- Preferred name
- (R)-6-(3-(2-ethoxyphenoxy)piperidin-1-yl)nicotinic acid
- IUPAC
- 6-[(3R)-3-(2-ethoxyphenoxy)piperidin-1-yl]pyridine-3-carboxylic acid
Names & synonyms
SCHEMBL17077525DXKAKSJGIPAFRC-OAHLLOKOSA-N(R)-6-(3-(2-ethoxyphenoxy)piperidin-1-yl)nicotinic acid
Database identifiers
- PubChem CID
- 118366232
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 71.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 434
Related reactions
2 records
Compound notes
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