N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide

C12H10BrFN2O2S — CID 25035957

IUPACN-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide
SMILESCc1nc(NS(=O)(=O)c2ccccc2F)ccc1Br
InChIInChI=1S/C12H10BrFN2O2S/c1-8-9(13)6-7-12(15-8)16-19(17,18)11-5-3-2-4-10(11)14/h2-7H,1H3,(H,15,16)
InChIKeyAXPXOSJMWUEZFY-UHFFFAOYSA-N
MW345.19 g/mol
LogP3.09
Rot. Bonds3

About N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide

N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide (PubChem CID 25035957) has the molecular formula C12H10BrFN2O2S and a molecular weight of 345.19 g/mol. Its IUPAC name is N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide.

Molecular Properties

Compound NameN-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide
PubChem CID25035957
Molecular FormulaC12H10BrFN2O2S
Molecular Weight345.19 g/mol
Exact Mass343.96
IUPAC NameN-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide
SMILESCc1nc(NS(=O)(=O)c2ccccc2F)ccc1Br
InChIInChI=1S/C12H10BrFN2O2S/c1-8-9(13)6-7-12(15-8)16-19(17,18)11-5-3-2-4-10(11)14/h2-7H,1H3,(H,15,16)
InChIKeyAXPXOSJMWUEZFY-UHFFFAOYSA-N
XLogP3.09
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.19
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide 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

N-(5-bromo-6-methyl-2-pyridinyl)-2-cyano-3-fluorobenzenesulfonamide
CID 79041116
N-(5-bromo-6-methyl-2-pyridinyl)-2,4-difluorobenzenesulfonamide
CID 5237791
2-amino-N-(5-bromo-6-methyl-2-pyridinyl)-5-fluorobenzenesulfonamide
CID 79048558
5-amino-3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide
CID 79042026
N-(5-bromo-6-methyl-2-pyridinyl)-2-hydrazinylpyridine-3-sulfonamide
CID 79048219
N-(6-bromo-2-methyl-3-pyridinyl)-2-fluorobenzenesulfonamide
CID 113349565
N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide
CID 25042631
N-(5-bromo-4-fluoro-2-methylphenyl)-2-fluorobenzenesulfonamide
CID 103223902
N-(5-amino-2-bromo-4-methylphenyl)-2-fluorobenzenesulfonamide
CID 104814667
N-(5-bromo-6-methyl-2-pyridinyl)-2-(methylaminomethyl)thiophene-3-sulfonamide
CID 106070384
5-bromo-4-[(5-bromo-6-methyl-2-pyridinyl)sulfamoyl]thiophene-2-carboxylic acid
CID 79041139
N-(5-bromo-6-methyl-2-pyridinyl)-2-(ethylaminomethyl)thiophene-3-sulfonamide
CID 106070393

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide?
The IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide (CID 25035957) is N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide.
What is the SMILES notation for N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide?
The canonical SMILES for N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide is Cc1nc(NS(=O)(=O)c2ccccc2F)ccc1Br.
What is the InChIKey of N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide?
The InChIKey is AXPXOSJMWUEZFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrFN2O2S/c1-8-9(13)6-7-12(15-8)16-19(17,18)11-5-3-2-4-10(11)14/h2-7H,1H3,(H,15,16).
What are the key properties of N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide?
N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide has a molecular weight of 345.19 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide is sourced from PubChem (CID 25035957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).