2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide

C12H11Br2N3O2S — CID 62145114

IUPAC2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide
SMILESCc1cc(Br)c(NS(=O)(=O)c2cccnc2N)c(Br)c1
InChIInChI=1S/C12H11Br2N3O2S/c1-7-5-8(13)11(9(14)6-7)17-20(18,19)10-3-2-4-16-12(10)15/h2-6,17H,1H3,(H2,15,16)
InChIKeyFCONXBJWWPDWEG-UHFFFAOYSA-N
MW421.11 g/mol
LogP3.30
Rot. Bonds3

About 2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide

2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide (PubChem CID 62145114) has the molecular formula C12H11Br2N3O2S and a molecular weight of 421.11 g/mol. Its IUPAC name is 2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide
PubChem CID62145114
Molecular FormulaC12H11Br2N3O2S
Molecular Weight421.11 g/mol
Exact Mass418.89
IUPAC Name2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide
SMILESCc1cc(Br)c(NS(=O)(=O)c2cccnc2N)c(Br)c1
InChIInChI=1S/C12H11Br2N3O2S/c1-7-5-8(13)11(9(14)6-7)17-20(18,19)10-3-2-4-16-12(10)15/h2-6,17H,1H3,(H2,15,16)
InChIKeyFCONXBJWWPDWEG-UHFFFAOYSA-N
XLogP3.30
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.11
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-bromo-4-chlorophenyl)pyridine-3-sulfonamide
CID 81262495
2-amino-N-(2-bromo-4-fluorophenyl)pyridine-3-sulfonamide
CID 62144064
2-amino-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-sulfonamide
CID 62149534
2-amino-N-(4-bromothiophen-2-yl)pyridine-3-sulfonamide
CID 115119280
2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)pyridine-3-sulfonamide
CID 62145923
2-amino-N-(2,5-difluoro-4-methylphenyl)pyridine-3-sulfonamide
CID 103584410
N-(2,6-dibromo-4-methylphenyl)benzenesulfonamide
CID 60640316
2-amino-N-(4-fluoro-2-methylphenyl)pyridine-3-sulfonamide
CID 55044474
2-amino-N-(4-iodophenyl)pyridine-3-sulfonamide
CID 62143904
2-amino-N-(3-methyl-4-pyridinyl)pyridine-3-sulfonamide
CID 63672409
2-cyano-N-(2,4,6-tribromophenyl)pyridine-3-sulfonamide
CID 106595571
2-amino-N-(3-fluoro-2-methylphenyl)pyridine-3-sulfonamide
CID 62158167

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide?
The IUPAC name of 2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide (CID 62145114) is 2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide is Cc1cc(Br)c(NS(=O)(=O)c2cccnc2N)c(Br)c1.
What is the InChIKey of 2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide?
The InChIKey is FCONXBJWWPDWEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Br2N3O2S/c1-7-5-8(13)11(9(14)6-7)17-20(18,19)10-3-2-4-16-12(10)15/h2-6,17H,1H3,(H2,15,16).
What are the key properties of 2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide?
2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide has a molecular weight of 421.11 g/mol, XLogP of 3.30, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 62145114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).