Methyl 2-(3-cyano-4-fluorophenyl)isonicotinate

HCID 66995083
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Basic information

Standard SMILES
COC(=O)c1ccnc(-c2ccc(F)c(C#N)c2)c1
InChIKey
PQJLOLLQBYAIIT-UHFFFAOYSA-N
Molecular formula
C14H9FN2O2
Average molar mass
256.23 g/mol

Names & identifiers

Preferred name
Methyl 2-(3-cyano-4-fluorophenyl)isonicotinate
IUPAC
methyl 2-(3-cyano-4-fluorophenyl)pyridine-4-carboxylate

Names & synonyms

SCHEMBL1329804PQJLOLLQBYAIIT-UHFFFAOYSA-Nmethyl 2-(3-cyano-4-fluorophenyl)isonicotinate

Database identifiers

PubChem CID
66995083

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
63 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
19

Related reactions

18 records
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Compound notes

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