6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid

C11H9N3O4S — CID 63872213

IUPAC6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(S(=O)(=O)Nc2ccccn2)nc1
InChIInChI=1S/C11H9N3O4S/c15-11(16)8-4-5-10(13-7-8)19(17,18)14-9-3-1-2-6-12-9/h1-7H,(H,12,14)(H,15,16)
InChIKeyQZBPFKNGUTVVCK-UHFFFAOYSA-N
MW279.28 g/mol
LogP0.98
Rot. Bonds4

About 6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid

6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid (PubChem CID 63872213) has the molecular formula C11H9N3O4S and a molecular weight of 279.28 g/mol. Its IUPAC name is 6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid
PubChem CID63872213
Molecular FormulaC11H9N3O4S
Molecular Weight279.28 g/mol
Exact Mass279.03
IUPAC Name6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(S(=O)(=O)Nc2ccccn2)nc1
InChIInChI=1S/C11H9N3O4S/c15-11(16)8-4-5-10(13-7-8)19(17,18)14-9-3-1-2-6-12-9/h1-7H,(H,12,14)(H,15,16)
InChIKeyQZBPFKNGUTVVCK-UHFFFAOYSA-N
XLogP0.98
TPSA109.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.28
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[[4-(pyridin-2-ylsulfamoyl)phenyl]sulfamoyl]benzoic acid
CID 4918646
6-[(5-cyano-2-pyridinyl)sulfamoyl]pyridine-3-carboxylic acid
CID 63874149
6-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-3-carboxylic acid
CID 103298756
6-[(2-hydroxyphenyl)methylsulfamoyl]pyridine-3-carboxylic acid
CID 114331356
6-[(2-chlorophenyl)sulfonylamino]pyridine-3-carboxylic acid
CID 61319210
6-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]sulfamoyl]pyridine-3-carboxylic acid
CID 107848275
6-[(4-methylsulfanylphenyl)sulfamoyl]pyridine-3-carboxylic acid
CID 63872781
6-[(4-methyl-1H-pyrazol-5-yl)sulfamoyl]pyridine-3-carboxylic acid
CID 113433482
6-[(5-bromo-1,3-thiazol-2-yl)sulfamoyl]pyridine-3-carboxylic acid
CID 63874506
6-[(3-fluoro-2-methylphenyl)sulfamoyl]pyridine-3-carboxylic acid
CID 63873772
6-[(3-chloro-2-methylphenyl)sulfamoyl]pyridine-3-carboxylic acid
CID 63872589
5-(pyridin-2-ylsulfamoyl)furan-2-carboxylic acid
CID 1322341

Frequently Asked Questions

What is the IUPAC name of 6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid?
The IUPAC name of 6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid (CID 63872213) is 6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid?
The canonical SMILES for 6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid is O=C(O)c1ccc(S(=O)(=O)Nc2ccccn2)nc1.
What is the InChIKey of 6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid?
The InChIKey is QZBPFKNGUTVVCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O4S/c15-11(16)8-4-5-10(13-7-8)19(17,18)14-9-3-1-2-6-12-9/h1-7H,(H,12,14)(H,15,16).
What are the key properties of 6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid?
6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid has a molecular weight of 279.28 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid is sourced from PubChem (CID 63872213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).