Basic information
- Standard SMILES
Cc1cc(CCCCc2ccccc2)nc(-n2c(C)ccc2C)c1- InChIKey
NDKMVGQSRHGSSC-UHFFFAOYSA-N- Molecular formula
- C22H26N2
- Average molar mass
- 318.5 g/mol
Names & identifiers
- Preferred name
- 4-Methyl-2-(2,5-dimethylpyrrol-1-yl)-6-(4-phenylbutyl)pyridine
- IUPAC
- 2-(2,5-dimethylpyrrol-1-yl)-4-methyl-6-(4-phenylbutyl)pyridine
Names & synonyms
SCHEMBL8330686NDKMVGQSRHGSSC-UHFFFAOYSA-NDB-0906884-methyl-2-(2,5-dimethylpyrrol-1-yl)-6-(4-phenylbutyl)pyridine179554-84-8
Database identifiers
- PubChem CID
- 21834420
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 353
Related reactions
3 records
Compound notes
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