2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile

C19H11FN4 — CID 82565303

IUPAC2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
SMILESN#Cc1cc(-c2ccccc2)cn2nc(-c3ccccc3F)nc12
InChIInChI=1S/C19H11FN4/c20-17-9-5-4-8-16(17)18-22-19-14(11-21)10-15(12-24(19)23-18)13-6-2-1-3-7-13/h1-10,12H
InChIKeySNFYPKNTKYSEKP-UHFFFAOYSA-N
MW314.32 g/mol
LogP4.07
Rot. Bonds2

About 2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile

2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (PubChem CID 82565303) has the molecular formula C19H11FN4 and a molecular weight of 314.32 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile.

Molecular Properties

Compound Name2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
PubChem CID82565303
Molecular FormulaC19H11FN4
Molecular Weight314.32 g/mol
Exact Mass314.10
IUPAC Name2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
SMILESN#Cc1cc(-c2ccccc2)cn2nc(-c3ccccc3F)nc12
InChIInChI=1S/C19H11FN4/c20-17-9-5-4-8-16(17)18-22-19-14(11-21)10-15(12-24(19)23-18)13-6-2-1-3-7-13/h1-10,12H
InChIKeySNFYPKNTKYSEKP-UHFFFAOYSA-N
XLogP4.07
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.32
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The IUPAC name of 2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (CID 82565303) is 2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile.
What is the SMILES notation for 2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The canonical SMILES for 2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile is N#Cc1cc(-c2ccccc2)cn2nc(-c3ccccc3F)nc12.
What is the InChIKey of 2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The InChIKey is SNFYPKNTKYSEKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11FN4/c20-17-9-5-4-8-16(17)18-22-19-14(11-21)10-15(12-24(19)23-18)13-6-2-1-3-7-13/h1-10,12H.
What are the key properties of 2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile has a molecular weight of 314.32 g/mol, XLogP of 4.07, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile is sourced from PubChem (CID 82565303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).