Basic information
- Standard SMILES
Cc1nc(C#Cc2cccc(C#N)c2)cn1-c1cncc(F)c1- InChIKey
VIXOHDVCVZDFIO-UHFFFAOYSA-N- Molecular formula
- C18H11FN4
- Average molar mass
- 302.3 g/mol
Names & identifiers
- Preferred name
- 3-[1-(5-Fluoro-pyridin-3-yl)-2-methyl-1H-imidazol-4-ylethynyl]-benzonitrile
- IUPAC
- 3-[2-[1-(5-fluoro-3-pyridinyl)-2-methylimidazol-4-yl]ethynyl]benzonitrile
Names & synonyms
SCHEMBL1022075VIXOHDVCVZDFIO-UHFFFAOYSA-N3-[1-(5-Fluoro-pyridin-3-yl)-2-methyl-1H-imidazol-4-ylethynyl]-benzonitrile
Database identifiers
- PubChem CID
- 66879288
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 527
Related reactions
4 records
Compound notes
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