Basic information
- Standard SMILES
CCCCC=CCCOc1ccc(-c2ccc(CCCCCOCCC)cc2)nc1- InChIKey
DTNMWSPDDPXHOF-UHFFFAOYSA-N- Molecular formula
- C27H39NO2
- Average molar mass
- 409.6 g/mol
- Monoisotopic mass
- 409.29807949
Names & identifiers
- Preferred name
- 5-Oct-3-enoxy-2-[4-(5-propoxypentyl)phenyl]pyridine
- IUPAC
- 5-oct-3-enoxy-2-[4-(5-propoxypentyl)phenyl]pyridine
Names & synonyms
SCHEMBL8593980
Database identifiers
- PubChem CID
- 53778480
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 16
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 417
Related reactions
1 records
Compound notes
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