6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid

C10H11N3O5S — CID 168719374

IUPAC6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid
SMILESNS(=O)(=O)C1CC(=O)N(c2cccc(C(=O)O)n2)C1
InChIInChI=1S/C10H11N3O5S/c11-19(17,18)6-4-9(14)13(5-6)8-3-1-2-7(12-8)10(15)16/h1-3,6H,4-5H2,(H,15,16)(H2,11,17,18)
InChIKeyZGHCJGMAZQIEFY-UHFFFAOYSA-N
MW285.28 g/mol
LogP-0.83
Rot. Bonds3

About 6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid

6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid (PubChem CID 168719374) has the molecular formula C10H11N3O5S and a molecular weight of 285.28 g/mol. Its IUPAC name is 6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid
PubChem CID168719374
Molecular FormulaC10H11N3O5S
Molecular Weight285.28 g/mol
Exact Mass285.04
IUPAC Name6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid
SMILESNS(=O)(=O)C1CC(=O)N(c2cccc(C(=O)O)n2)C1
InChIInChI=1S/C10H11N3O5S/c11-19(17,18)6-4-9(14)13(5-6)8-3-1-2-7(12-8)10(15)16/h1-3,6H,4-5H2,(H,15,16)(H2,11,17,18)
InChIKeyZGHCJGMAZQIEFY-UHFFFAOYSA-N
XLogP-0.83
TPSA130.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.28
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid?
The IUPAC name of 6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid (CID 168719374) is 6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid is NS(=O)(=O)C1CC(=O)N(c2cccc(C(=O)O)n2)C1.
What is the InChIKey of 6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid?
The InChIKey is ZGHCJGMAZQIEFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O5S/c11-19(17,18)6-4-9(14)13(5-6)8-3-1-2-7(12-8)10(15)16/h1-3,6H,4-5H2,(H,15,16)(H2,11,17,18).
What are the key properties of 6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid?
6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid has a molecular weight of 285.28 g/mol, XLogP of -0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-oxo-4-sulfamoylpyrrolidin-1-yl)pyridine-2-carboxylic acid is sourced from PubChem (CID 168719374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).