Basic information
- Standard SMILES
C=CCC1CCCC(OCc2nc(-c3cccc(C)c3)oc2C)C1- InChIKey
MXSGSUKEKIPPTL-UHFFFAOYSA-N- Molecular formula
- C21H27NO2
- Average molar mass
- 325.4 g/mol
Names & identifiers
- Preferred name
- 5-Methyl-2-(3-methylphenyl)-4-[(3-prop-2-enylcyclohexyl)oxymethyl]-1,3-oxazole
- IUPAC
- 5-methyl-2-(3-methylphenyl)-4-[(3-prop-2-enylcyclohexyl)oxymethyl]-1,3-oxazole
Names & synonyms
SCHEMBL3964778
Database identifiers
- PubChem CID
- 58763373
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 399
Related reactions
2 records
Compound notes
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