Ethanone, 1-[1,4-dihydro-1-(phenylmethyl)-3-pyridinyl]-
Basic information
- CAS
19350-64-2- Standard SMILES
CC(=O)C1=CN(Cc2ccccc2)C=CC1- InChIKey
XJYYZGLSXLQVOD-UHFFFAOYSA-N- Molecular formula
- C14H15NO
- Average molar mass
- 213.27 g/mol
- Monoisotopic mass
- 213.1153641
Names & identifiers
- Preferred name
- Ethanone, 1-[1,4-dihydro-1-(phenylmethyl)-3-pyridinyl]-
- IUPAC
- 1-(1-benzyl-4H-pyridin-3-yl)ethanone
- English name
- 1-Benzyl-3-acetyl-1,4-dihydropyridine
- Molecular formula
- C14H15NO
- Molecular weight
- 213.27
Names & synonyms
19350-64-23-Acetyl-1-benzyl-1,4-dihydropyridineEthanone, 1-[1,4-dihydro-1-(phenylmethyl)-3-pyridinyl]-1-(1-benzyl-1,4-dihydropyridin-3-yl)ethan-1-one1-(1-Benzyl-1,4-dihydropyridin-3-yl)ethanoneSCHEMBL17785185DTXSID40460503AC9303MFCD30591969SY2513421-Benzyl-3-acetyl-1,4-dihydropyridineN-benzyl-3-acetyl-1,4-dihydropyridine
Database identifiers
- CAS
19350-64-2- PubChem CID
- 11264339
- DTXSID
DTXSID40460503- Nikkaji
- J329.401C
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 311
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
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Compound notes
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