Basic information
- Standard SMILES
N#CC1=C(Nc2ccc(F)cc2)c2ccccc2CC1- InChIKey
OVNFBXABFFJIEP-UHFFFAOYSA-N- Molecular formula
- C17H13FN2
- Average molar mass
- 264.3 g/mol
- Monoisotopic mass
- 264.10627659
Names & identifiers
- Preferred name
- 1-(4'Fluorophenyl) amino-2-cyano-3,4-dihydro-naphthalene
- IUPAC
- 1-(4-fluoroanilino)-3,4-dihydronaphthalene-2-carbonitrile
Names & synonyms
SCHEMBL8018197OVNFBXABFFJIEP-UHFFFAOYSA-N1-(4'Fluorophenyl) amino-2-cyano-3,4-dihydro-naphthalene
Database identifiers
- PubChem CID
- 70256010
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 35.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 426
Related reactions
2 records
Compound notes
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