Basic information
- CAS
102571-16-4- Standard SMILES
CN1CCCC(OC(=O)C(O)(Cc2ccccc2)C2CC2)C1- InChIKey
BFVRZRLPMIQNMG-UHFFFAOYSA-N- Molecular formula
- C18H25NO3
- Average molar mass
- 303.4 g/mol
- Monoisotopic mass
- 303.18344366
Names & identifiers
- Preferred name
- 1-Methylpiperidin-3-yl 2-cyclopropyl-2-hydroxy-3-phenylpropanoate
- IUPAC
- (1-methylpiperidin-3-yl) 2-cyclopropyl-2-hydroxy-3-phenylpropanoate
Names & synonyms
102571-16-41-methylpiperidin-3-yl 2-cyclopropyl-2-hydroxy-3-phenylpropanoateDTXSID30907735RefChem:1055865DTXCID0013368241-Methyl-3-piperidyl benzylcyclopropylglycolatealpha-Benzylcyclopropaneglycolic acid 1-methyl-3-piperidyl esterCYCLOPROPANEGLYCOLIC ACID, alpha-BENZYL-, 1-METHYL-3-PIPERIDYL ESTER
Database identifiers
- CAS
102571-16-4- PubChem CID
- 59491
- DTXSID
DTXSID30907735- Nikkaji
- J85.267H
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 390
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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