1-Benzyl-1,2-dihydro-2-[(4-methoxyphenyl)methyl]-3,4-dimethylpyridine
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Basic information
- CAS
22185-50-8- Standard SMILES
COc1ccc(CC2C(C)=C(C)C=CN2Cc2ccccc2)cc1- InChIKey
KSKPCURZYVZTBP-UHFFFAOYSA-N- Molecular formula
- C22H25NO
- Average molar mass
- 319.4 g/mol
- Monoisotopic mass
- 319.19361442
Names & identifiers
- Preferred name
- 1-Benzyl-1,2-dihydro-2-[(4-methoxyphenyl)methyl]-3,4-dimethylpyridine
- IUPAC
- 1-benzyl-2-[(4-methoxyphenyl)methyl]-3,4-dimethyl-2H-pyridine
- English name
- 1-benzyl-1,2-dihydro-2-[(4-methoxyphenyl)methyl]-3,4-dimethylpyridine
- Molecular formula
- C22H25NO
- Molecular weight
- 319.44
Names & synonyms
22185-50-81-BENZYL-1,2-DIHYDRO-2-[(4-METHOXYPHENYL)METHYL]-3,4-DIMETHYLPYRIDINE1-Benzyl-1,2-dihydro-2-((4-methoxyphenyl)methyl)-3,4-dimethylpyridineEINECS 244-825-61-benzyl-2-(4-methoxybenzyl)-3,4-dimethyl-1,2-dihydropyridineDTXSID60944835KSKPCURZYVZTBP-UHFFFAOYSA-N1-Benzyl-2-[(4-methoxyphenyl)methyl]-3,4-dimethyl-1,2-dihydropyridineDS-021444NS00049877Pentazocine Impurity 251,2-Dihydro-2-[(4-methoxyphenyl)methyl]-3,4-dimethyl-1-(phenylmethyl)pyridine
Database identifiers
- CAS
22185-50-8- PubChem CID
- 90747
- DTXSID
DTXSID60944835- EC Number
- 244-825-6
- Nikkaji
- J285.455D
Properties
Computed structural propertiesFilling in
- XLogP
- 4.6
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 453
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