4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid

C11H8FN3O4S — CID 103298797

IUPAC4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid
SMILESO=C(O)c1cc(NS(=O)(=O)c2ncccc2F)ccn1
InChIInChI=1S/C11H8FN3O4S/c12-8-2-1-4-14-10(8)20(18,19)15-7-3-5-13-9(6-7)11(16)17/h1-6H,(H,13,15)(H,16,17)
InChIKeyAMWFTJQGWGECNF-UHFFFAOYSA-N
MW297.27 g/mol
LogP1.11
Rot. Bonds4

About 4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid

4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid (PubChem CID 103298797) has the molecular formula C11H8FN3O4S and a molecular weight of 297.27 g/mol. Its IUPAC name is 4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid
PubChem CID103298797
Molecular FormulaC11H8FN3O4S
Molecular Weight297.27 g/mol
Exact Mass297.02
IUPAC Name4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid
SMILESO=C(O)c1cc(NS(=O)(=O)c2ncccc2F)ccn1
InChIInChI=1S/C11H8FN3O4S/c12-8-2-1-4-14-10(8)20(18,19)15-7-3-5-13-9(6-7)11(16)17/h1-6H,(H,13,15)(H,16,17)
InChIKeyAMWFTJQGWGECNF-UHFFFAOYSA-N
XLogP1.11
TPSA109.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.27
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-4-[(3-fluoro-2-pyridinyl)sulfonylamino]benzoic acid
CID 103298758
N-(3-acetylphenyl)-3-fluoropyridine-2-sulfonamide
CID 103299384
N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide
CID 103299127
6-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-3-carboxylic acid
CID 103298756
4-[(3-fluoro-2-pyridinyl)sulfonylamino]benzamide
CID 103299122
4-[(2-bromo-4-fluorophenyl)sulfonylamino]pyridine-2-carboxylic acid
CID 63650957
3-[(3-fluoro-2-pyridinyl)sulfonylamino]benzenecarbothioamide
CID 103300636
5-amino-2-[(3-fluoro-2-pyridinyl)sulfonylamino]benzoic acid
CID 103298604
2-[(3-fluoro-2-pyridinyl)sulfonylamino]-5-methylbenzoic acid
CID 103298700
5-[(3-fluoro-2-pyridinyl)sulfonylamino]-3-methylthiophene-2-carboxylic acid
CID 103298683
3-fluoro-N-(2-fluorophenyl)pyridine-2-sulfonamide
CID 103299037
4-[(3-fluoro-2-pyridinyl)sulfonylamino]benzenecarbothioamide
CID 103300634

Frequently Asked Questions

What is the IUPAC name of 4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid?
The IUPAC name of 4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid (CID 103298797) is 4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid.
What is the SMILES notation for 4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid?
The canonical SMILES for 4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid is O=C(O)c1cc(NS(=O)(=O)c2ncccc2F)ccn1.
What is the InChIKey of 4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid?
The InChIKey is AMWFTJQGWGECNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FN3O4S/c12-8-2-1-4-14-10(8)20(18,19)15-7-3-5-13-9(6-7)11(16)17/h1-6H,(H,13,15)(H,16,17).
What are the key properties of 4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid?
4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid has a molecular weight of 297.27 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-fluoro-2-pyridinyl)sulfonylamino]pyridine-2-carboxylic acid is sourced from PubChem (CID 103298797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).