2-Acetyl-1-(3-fluorophenyl)-1,2,3,9-tetrahydrospiro[beta-carboline-4,1'-cyclopropane]
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Basic information
- Standard SMILES
CC(=O)N1CC2(CC2)c2c([nH]c3ccccc23)C1c1cccc(F)c1- InChIKey
AHTVDGPINRCYGH-UHFFFAOYSA-N- Molecular formula
- C21H19FN2O
- Average molar mass
- 334.4 g/mol
Names & identifiers
- Preferred name
- 2-Acetyl-1-(3-fluorophenyl)-1,2,3,9-tetrahydrospiro[beta-carboline-4,1'-cyclopropane]
- IUPAC
- 1-[1-(3-fluorophenyl)spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,1'-cyclopropane]-2-yl]ethanone
Names & synonyms
SCHEMBL999416AHTVDGPINRCYGH-UHFFFAOYSA-N2-acetyl-1-(3-fluorophenyl)-1,2,3,9-tetrahydrospiro[beta-carboline-4,1'-cyclopropane]
Database identifiers
- PubChem CID
- 11244535
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 36.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 548
Related reactions
1 records
Compound notes
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