3-Piperidinecarboxylic acid, 1-[(phenylamino)carbonyl]-, (3R)-
Basic information
- CAS
827612-82-8- Standard SMILES
O=C(O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1- InChIKey
UKCJZGIJDOLOQJ-SNVBAGLBSA-N- Molecular formula
- C13H16N2O3
- Average molar mass
- 248.28 g/mol
- Monoisotopic mass
- 248.11609238
Names & identifiers
- Preferred name
- 3-Piperidinecarboxylic acid, 1-[(phenylamino)carbonyl]-, (3R)-
- IUPAC
- (3R)-1-(phenylcarbamoyl)piperidine-3-carboxylic acid
Names & synonyms
DTXSID304294673-Piperidinecarboxylic acid, 1-[(phenylamino)carbonyl]-, (3R)-AKOS019687774827612-82-8(3R)-1-(PHENYLCARBAMOYL)PIPERIDINE-3-CARBOXYLIC ACID
Database identifiers
- CAS
827612-82-8- PubChem CID
- 9533907
- DTXSID
DTXSID30429467
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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