6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide

C8H10ClN3O3S — CID 62234708

IUPAC6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide
SMILESNS(=O)(=O)CCNC(=O)c1cccc(Cl)n1
InChIInChI=1S/C8H10ClN3O3S/c9-7-3-1-2-6(12-7)8(13)11-4-5-16(10,14)15/h1-3H,4-5H2,(H,11,13)(H2,10,14,15)
InChIKeyGLDQGOYMXFDHAJ-UHFFFAOYSA-N
MW263.71 g/mol
LogP-0.25
Rot. Bonds4

About 6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide

6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide (PubChem CID 62234708) has the molecular formula C8H10ClN3O3S and a molecular weight of 263.71 g/mol. Its IUPAC name is 6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide
PubChem CID62234708
Molecular FormulaC8H10ClN3O3S
Molecular Weight263.71 g/mol
Exact Mass263.01
IUPAC Name6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide
SMILESNS(=O)(=O)CCNC(=O)c1cccc(Cl)n1
InChIInChI=1S/C8H10ClN3O3S/c9-7-3-1-2-6(12-7)8(13)11-4-5-16(10,14)15/h1-3H,4-5H2,(H,11,13)(H2,10,14,15)
InChIKeyGLDQGOYMXFDHAJ-UHFFFAOYSA-N
XLogP-0.25
TPSA102.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.71
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
The IUPAC name of 6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide (CID 62234708) is 6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide is NS(=O)(=O)CCNC(=O)c1cccc(Cl)n1.
What is the InChIKey of 6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
The InChIKey is GLDQGOYMXFDHAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3O3S/c9-7-3-1-2-6(12-7)8(13)11-4-5-16(10,14)15/h1-3H,4-5H2,(H,11,13)(H2,10,14,15).
What are the key properties of 6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide has a molecular weight of 263.71 g/mol, XLogP of -0.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 62234708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).