Basic information
- Standard SMILES
CCCCC1Cc2cc(N)c(F)cc2C1=O- InChIKey
PXGVPRCSRQKMCV-UHFFFAOYSA-N- Molecular formula
- C13H16FNO
- Average molar mass
- 221.27 g/mol
Names & identifiers
- Preferred name
- 5-Amino-2-butyl-6-fluoro-1-indanone
- IUPAC
- 5-amino-2-butyl-6-fluoro-2,3-dihydroinden-1-one
Names & synonyms
SCHEMBL5344098PXGVPRCSRQKMCV-UHFFFAOYSA-N5-amino-2-butyl-6-fluoro-1-indanone
Database identifiers
- PubChem CID
- 17972717
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 269
Related reactions
5 records
Compound notes
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