Basic information
- Standard SMILES
C=CCN(CCC)C1COc2cccc(C(C)=O)c2C1- InChIKey
ZIBKQBLITBEYHJ-UHFFFAOYSA-N- Molecular formula
- C17H23NO2
- Average molar mass
- 273.37 g/mol
Names & identifiers
- Preferred name
- 5-acetyl-3-(N-allyl-N-n-propylamino)chroman
- IUPAC
- 1-[3-[prop-2-enyl(propyl)amino]-3,4-dihydro-2H-chromen-5-yl]ethanone
Names & synonyms
SCHEMBL8823716ZIBKQBLITBEYHJ-UHFFFAOYSA-N5-acetyl-3-(N-allyl-N-n-propylamino)chroman5-acetyl-3-(N-allyl-N-n-propylamino)-chroman
Database identifiers
- PubChem CID
- 19028089
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 342
Related reactions
10 records
Compound notes
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