6-methyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carboxylic acid
Basic information
- CAS
423120-02-9- Standard SMILES
CC1=C(C(=O)O)C(c2ccccc2)CC(=O)N1- InChIKey
MNMDMPKCLQCVPF-UHFFFAOYSA-N- Molecular formula
- C13H13NO3
- Average molar mass
- 231.25 g/mol
- Monoisotopic mass
- 231.08954328
Names & identifiers
- Preferred name
- 6-methyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carboxylic acid
- IUPAC
- 6-methyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carboxylic acid
Names & synonyms
423120-02-96-methyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carboxylic acidDTXSID10295925RefChem:308962DTXCID90247063NSC1063001,4,5,6-TETRAHYDRO-2-METHYL-6-OXO-4-(4-PHENYL)-3-PYRIDINECARBOXYLIC ACID2-Methyl-6-oxo-4-phenyl-1,4,5,6-tetrahydropyridine-3-carboxylic acidNSC-106300
Database identifiers
- CAS
423120-02-9- PubChem CID
- 267175
- DTXSID
DTXSID10295925- Nikkaji
- J1.650.652D
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 367
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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