1-[(2E)-3-phenylprop-2-enoyl]piperidine-4-carboxylic acid
Basic information
- CAS
147636-43-9- Standard SMILES
O=C(O)C1CCN(C(=O)/C=C/c2ccccc2)CC1- InChIKey
BARCAQQBDOOISH-VOTSOKGWSA-N- Molecular formula
- C15H17NO3
- Average molar mass
- 259.3 g/mol
- Monoisotopic mass
- 259.1208434
Names & identifiers
- Preferred name
- 1-[(2E)-3-phenylprop-2-enoyl]piperidine-4-carboxylic acid
- IUPAC
- 1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxylic acid
Names & synonyms
1-[(2E)-3-phenylprop-2-enoyl]piperidine-4-carboxylic acid1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxylic acid147636-43-9SCHEMBL27568108DTXSID401167950HMS1717C21AKOS000202909AKOS023869517EN300-107551-CINNAMOYLPIPERIDINE-4-CARBOXYLIC ACIDG31466AB00744769-01
Show more names
SR-01000057705SR-01000057705-11-(3-phenylprop-2-enoyl)piperidine-4-carboxylicAcidZ563475784-Piperidinecarboxylic acid, 1-(1-oxo-3-phenyl-2-propenyl)-, (E)-
Database identifiers
- CAS
147636-43-9- PubChem CID
- 2473095
- DTXSID
DTXSID401167950
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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