6-(sulfamoylamino)pyridine-2-carboxylic acid

C6H7N3O4S — CID 114958876

IUPAC6-(sulfamoylamino)pyridine-2-carboxylic acid
SMILESNS(=O)(=O)Nc1cccc(C(=O)O)n1
InChIInChI=1S/C6H7N3O4S/c7-14(12,13)9-5-3-1-2-4(8-5)6(10)11/h1-3H,(H,8,9)(H,10,11)(H2,7,12,13)
InChIKeyOAEDQMLMMPSUAR-UHFFFAOYSA-N
MW217.21 g/mol
LogP-0.60
Rot. Bonds3

About 6-(sulfamoylamino)pyridine-2-carboxylic acid

6-(sulfamoylamino)pyridine-2-carboxylic acid (PubChem CID 114958876) has the molecular formula C6H7N3O4S and a molecular weight of 217.21 g/mol. Its IUPAC name is 6-(sulfamoylamino)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(sulfamoylamino)pyridine-2-carboxylic acid
PubChem CID114958876
Molecular FormulaC6H7N3O4S
Molecular Weight217.21 g/mol
Exact Mass217.02
IUPAC Name6-(sulfamoylamino)pyridine-2-carboxylic acid
SMILESNS(=O)(=O)Nc1cccc(C(=O)O)n1
InChIInChI=1S/C6H7N3O4S/c7-14(12,13)9-5-3-1-2-4(8-5)6(10)11/h1-3H,(H,8,9)(H,10,11)(H2,7,12,13)
InChIKeyOAEDQMLMMPSUAR-UHFFFAOYSA-N
XLogP-0.60
TPSA122.38 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.21
LogP ≤ 5-0.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-Pyridinedicarboxylic acid
CID 10367
6-Acetamidopicolinic acid
CID 824640
6-Aminopyridine-2-carboxylic acid
CID 351652
6-Fluoropyridine-2-carboxylic acid
CID 226027
6-Nitropyridine-2-carboxylic acid
CID 578841
5-Acetamido-6-guanidino-pyridine-2-carboxylic acid
CID 5278295
Ethyl 6-Aminopyridine-2-carboxylate
CID 11959065
Methyl 6-aminopyridine-2-carboxylate
CID 13809143
6-(Prop-2-enamido)pyridine-2-carboxylic acid
CID 63642220
6-Amino-5-acetamidopyridine-2-carboxylic acid
CID 5278294
4,6-Diamino-5-(methanesulfonamido)pyridine-2-carboxylic acid
CID 5278297
2,6-Pyridinedicarboxylic acid, monosodium salt
CID 23690073

Frequently Asked Questions

What is the IUPAC name of 6-(sulfamoylamino)pyridine-2-carboxylic acid?
The IUPAC name of 6-(sulfamoylamino)pyridine-2-carboxylic acid (CID 114958876) is 6-(sulfamoylamino)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(sulfamoylamino)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(sulfamoylamino)pyridine-2-carboxylic acid is NS(=O)(=O)Nc1cccc(C(=O)O)n1.
What is the InChIKey of 6-(sulfamoylamino)pyridine-2-carboxylic acid?
The InChIKey is OAEDQMLMMPSUAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O4S/c7-14(12,13)9-5-3-1-2-4(8-5)6(10)11/h1-3H,(H,8,9)(H,10,11)(H2,7,12,13).
What are the key properties of 6-(sulfamoylamino)pyridine-2-carboxylic acid?
6-(sulfamoylamino)pyridine-2-carboxylic acid has a molecular weight of 217.21 g/mol, XLogP of -0.60, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(sulfamoylamino)pyridine-2-carboxylic acid is sourced from PubChem (CID 114958876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).