2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine

C18H13FN4O2S — CID 10109588

IUPAC2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine
SMILESCS(=O)(=O)c1nccc(-c2c(-c3ccc(F)cc3)nn3ccccc23)n1
InChIInChI=1S/C18H13FN4O2S/c1-26(24,25)18-20-10-9-14(21-18)16-15-4-2-3-11-23(15)22-17(16)12-5-7-13(19)8-6-12/h2-11H,1H3
InChIKeyIGOLYIRDPCNPIJ-UHFFFAOYSA-N
MW368.39 g/mol
LogP3.00
Rot. Bonds3

About 2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine

2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine (PubChem CID 10109588) has the molecular formula C18H13FN4O2S and a molecular weight of 368.39 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine
PubChem CID10109588
Molecular FormulaC18H13FN4O2S
Molecular Weight368.39 g/mol
Exact Mass368.07
IUPAC Name2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine
SMILESCS(=O)(=O)c1nccc(-c2c(-c3ccc(F)cc3)nn3ccccc23)n1
InChIInChI=1S/C18H13FN4O2S/c1-26(24,25)18-20-10-9-14(21-18)16-15-4-2-3-11-23(15)22-17(16)12-5-7-13(19)8-6-12/h2-11H,1H3
InChIKeyIGOLYIRDPCNPIJ-UHFFFAOYSA-N
XLogP3.00
TPSA77.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine?
The IUPAC name of 2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine (CID 10109588) is 2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine is CS(=O)(=O)c1nccc(-c2c(-c3ccc(F)cc3)nn3ccccc23)n1.
What is the InChIKey of 2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine?
The InChIKey is IGOLYIRDPCNPIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FN4O2S/c1-26(24,25)18-20-10-9-14(21-18)16-15-4-2-3-11-23(15)22-17(16)12-5-7-13(19)8-6-12/h2-11H,1H3.
What are the key properties of 2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine?
2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine has a molecular weight of 368.39 g/mol, XLogP of 3.00, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-3-(2-methylsulfonylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 10109588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).