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

C17H9FN4S — CID 82565393

IUPAC2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
SMILESN#Cc1ccc(-c2cccs2)n2nc(-c3ccccc3F)nc12
InChIInChI=1S/C17H9FN4S/c18-13-5-2-1-4-12(13)16-20-17-11(10-19)7-8-14(22(17)21-16)15-6-3-9-23-15/h1-9H
InChIKeyHYSDJAAGDSRMMH-UHFFFAOYSA-N
MW320.35 g/mol
LogP4.14
Rot. Bonds2

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

2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (PubChem CID 82565393) has the molecular formula C17H9FN4S and a molecular weight of 320.35 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile.

Molecular Properties

Compound Name2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
PubChem CID82565393
Molecular FormulaC17H9FN4S
Molecular Weight320.35 g/mol
Exact Mass320.05
IUPAC Name2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
SMILESN#Cc1ccc(-c2cccs2)n2nc(-c3ccccc3F)nc12
InChIInChI=1S/C17H9FN4S/c18-13-5-2-1-4-12(13)16-20-17-11(10-19)7-8-14(22(17)21-16)15-6-3-9-23-15/h1-9H
InChIKeyHYSDJAAGDSRMMH-UHFFFAOYSA-N
XLogP4.14
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-fluorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
CID 82565273
2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
CID 82567026
2-(2-fluorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
CID 82565303
2,5-dithiophen-2-ylbenzene-1,4-dicarbonitrile
CID 3632903
2-(4-aminophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82565686
5,7-dichloro-6-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 114514536
5-(2-chloroethyl)-2-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazole
CID 28709886
2-fluoro-4-(5-thiophen-2-ylthiophen-2-yl)benzonitrile
CID 155806543
5,8-dithiophen-2-yltetrazolo[1,5-a]pyridine
CID 122369491
2-methyl-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82565677
1-(2-methylpropyl)-2-oxo-6-thiophen-2-ylpyridine-3-carbonitrile
CID 82516710
5-(2-fluorophenyl)-3-thiophen-2-yl-1,2-oxazole
CID 99964161

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The IUPAC name of 2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (CID 82565393) is 2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile.
What is the SMILES notation for 2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The canonical SMILES for 2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile is N#Cc1ccc(-c2cccs2)n2nc(-c3ccccc3F)nc12.
What is the InChIKey of 2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The InChIKey is HYSDJAAGDSRMMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H9FN4S/c18-13-5-2-1-4-12(13)16-20-17-11(10-19)7-8-14(22(17)21-16)15-6-3-9-23-15/h1-9H.
What are the key properties of 2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile has a molecular weight of 320.35 g/mol, XLogP of 4.14, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile is sourced from PubChem (CID 82565393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).