3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid

C10H8FN3O4S — CID 165472351

IUPAC3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid
SMILESCS(=O)(=O)c1cnn(-c2nccc(C(=O)O)c2F)c1
InChIInChI=1S/C10H8FN3O4S/c1-19(17,18)6-4-13-14(5-6)9-8(11)7(10(15)16)2-3-12-9/h2-5H,1H3,(H,15,16)
InChIKeyXVUUOZMPYGTWBN-UHFFFAOYSA-N
MW285.26 g/mol
LogP0.51
Rot. Bonds3

About 3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid

3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid (PubChem CID 165472351) has the molecular formula C10H8FN3O4S and a molecular weight of 285.26 g/mol. Its IUPAC name is 3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid.

Molecular Properties

Compound Name3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid
PubChem CID165472351
Molecular FormulaC10H8FN3O4S
Molecular Weight285.26 g/mol
Exact Mass285.02
IUPAC Name3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid
SMILESCS(=O)(=O)c1cnn(-c2nccc(C(=O)O)c2F)c1
InChIInChI=1S/C10H8FN3O4S/c1-19(17,18)6-4-13-14(5-6)9-8(11)7(10(15)16)2-3-12-9/h2-5H,1H3,(H,15,16)
InChIKeyXVUUOZMPYGTWBN-UHFFFAOYSA-N
XLogP0.51
TPSA102.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.26
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[[3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)-4-pyridinyl]methyl]-3-propan-2-ylpyridin-4-one
CID 166310919
[3-chloro-2-(4-methylsulfonylpyrazol-1-yl)-4-pyridinyl]methanamine
CID 165472906
3-fluoro-2-(4-methylsulfonylanilino)pyridine-4-carboxylic acid
CID 105381849
(1S)-1-[2-(4-methylsulfonylpyrazol-1-yl)-3-pyridinyl]ethanamine
CID 165477558
3-fluoro-2-(4-methylpiperazin-1-yl)pyridine-4-carboxylic acid
CID 105381703
methyl 4-(4-methylsulfonylpyrazol-1-yl)pyrimidine-5-carboxylate
CID 165472274
3-fluoro-2-(3-methylsulfonylthiomorpholin-4-yl)pyridine-4-carboxylic acid
CID 105382451
6-methylsulfonylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 146100718
1-(3-fluoro-4-formyl-2-pyridinyl)pyrazole-4-carboxylic acid
CID 165460662
3-fluoro-2-(2,2,6,6-tetramethylmorpholin-4-yl)pyridine-4-carboxylic acid
CID 102744178
N-[1-[3-(4-methylsulfonylpyrazol-1-yl)pyrazin-2-yl]ethyl]-3,5-bis(trifluoromethyl)benzamide
CID 171812390
N'-hydroxy-4-(4-methylsulfonylpyrazol-1-yl)pyridine-2-carboximidamide
CID 165481074

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid?
The IUPAC name of 3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid (CID 165472351) is 3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid.
What is the SMILES notation for 3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid?
The canonical SMILES for 3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid is CS(=O)(=O)c1cnn(-c2nccc(C(=O)O)c2F)c1.
What is the InChIKey of 3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid?
The InChIKey is XVUUOZMPYGTWBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3O4S/c1-19(17,18)6-4-13-14(5-6)9-8(11)7(10(15)16)2-3-12-9/h2-5H,1H3,(H,15,16).
What are the key properties of 3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid?
3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid has a molecular weight of 285.26 g/mol, XLogP of 0.51, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid is sourced from PubChem (CID 165472351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).