5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide

C13H14BrN3O3S — CID 62144727

IUPAC5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide
SMILESCNc1ncc(Br)cc1S(=O)(=O)Nc1cccc(OC)c1
InChIInChI=1S/C13H14BrN3O3S/c1-15-13-12(6-9(14)8-16-13)21(18,19)17-10-4-3-5-11(7-10)20-2/h3-8,17H,1-2H3,(H,15,16)
InChIKeyWGABDLANUCOLOD-UHFFFAOYSA-N
MW372.24 g/mol
LogP2.70
Rot. Bonds5

About 5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide

5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide (PubChem CID 62144727) has the molecular formula C13H14BrN3O3S and a molecular weight of 372.24 g/mol. Its IUPAC name is 5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide
PubChem CID62144727
Molecular FormulaC13H14BrN3O3S
Molecular Weight372.24 g/mol
Exact Mass370.99
IUPAC Name5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide
SMILESCNc1ncc(Br)cc1S(=O)(=O)Nc1cccc(OC)c1
InChIInChI=1S/C13H14BrN3O3S/c1-15-13-12(6-9(14)8-16-13)21(18,19)17-10-4-3-5-11(7-10)20-2/h3-8,17H,1-2H3,(H,15,16)
InChIKeyWGABDLANUCOLOD-UHFFFAOYSA-N
XLogP2.70
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.24
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-2-(methylamino)-N-(3-methylsulfanylphenyl)pyridine-3-sulfonamide
CID 62164045
5-bromo-N-(4-fluorophenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62143306
5-bromo-N-(2,6-dichlorophenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 65498877
2-amino-5-bromo-N-(3-ethoxyphenyl)pyridine-3-sulfonamide
CID 62156694
5-bromo-N-(4-bromo-2-methylphenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62163010
N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 122220853
5-bromo-2-(methylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787819
5-bromo-N-(3-ethylphenyl)-2-hydrazinylpyridine-3-sulfonamide
CID 61298536
5-bromo-N-(2-bromo-4-chlorophenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 81280690
N-(6-bromo-3-pyridinyl)-3-methoxybenzenesulfonamide
CID 103775610
5-bromo-N-(5-bromo-4-methyl-2-pyridinyl)-2-(methylamino)pyridine-3-sulfonamide
CID 79736645
5-fluoro-2-methoxy-N-(3-methoxyphenyl)benzenesulfonamide
CID 17018087

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide?
The IUPAC name of 5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide (CID 62144727) is 5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide.
What is the SMILES notation for 5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide?
The canonical SMILES for 5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide is CNc1ncc(Br)cc1S(=O)(=O)Nc1cccc(OC)c1.
What is the InChIKey of 5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide?
The InChIKey is WGABDLANUCOLOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrN3O3S/c1-15-13-12(6-9(14)8-16-13)21(18,19)17-10-4-3-5-11(7-10)20-2/h3-8,17H,1-2H3,(H,15,16).
What are the key properties of 5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide?
5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide has a molecular weight of 372.24 g/mol, XLogP of 2.70, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(3-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 62144727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).