6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide

C12H11BrClN3O2S — CID 64602240

IUPAC6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide
SMILESCc1ccc(Br)cc1NS(=O)(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C12H11BrClN3O2S/c1-7-2-3-8(13)4-11(7)17-20(18,19)9-5-10(14)12(15)16-6-9/h2-6,17H,1H3,(H2,15,16)
InChIKeyXODJVICZEQVPPF-UHFFFAOYSA-N
MW376.66 g/mol
LogP3.19
Rot. Bonds3

About 6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide

6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide (PubChem CID 64602240) has the molecular formula C12H11BrClN3O2S and a molecular weight of 376.66 g/mol. Its IUPAC name is 6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide
PubChem CID64602240
Molecular FormulaC12H11BrClN3O2S
Molecular Weight376.66 g/mol
Exact Mass374.94
IUPAC Name6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide
SMILESCc1ccc(Br)cc1NS(=O)(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C12H11BrClN3O2S/c1-7-2-3-8(13)4-11(7)17-20(18,19)9-5-10(14)12(15)16-6-9/h2-6,17H,1H3,(H2,15,16)
InChIKeyXODJVICZEQVPPF-UHFFFAOYSA-N
XLogP3.19
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.66
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-5-chloro-N-(2-methylphenyl)pyridine-3-sulfonamide
CID 64608701
6-amino-N-(5-bromo-2-cyanophenyl)-5-chloropyridine-3-sulfonamide
CID 107801188
N-(5-bromo-2-methylphenyl)-2-chloropyrimidine-5-sulfonamide
CID 43805950
6-amino-5-chloro-N-(4-methyl-3-pyridinyl)pyridine-3-sulfonamide
CID 64601518
6-amino-N-(2-bromo-5-methylphenyl)-5-chloropyridine-3-sulfonamide
CID 82767078
6-amino-5-chloro-N-(3-chloro-2-methylphenyl)pyridine-3-sulfonamide
CID 64606596
6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide
CID 81275515
6-amino-N-[1-(4-bromophenyl)ethyl]-5-chloropyridine-3-sulfonamide
CID 64601294
N-(5-bromo-2-methylphenyl)-2-(ethylamino)pyrimidine-5-sulfonamide
CID 62146677
6-amino-5-chloro-N-(2,3-difluorophenyl)pyridine-3-sulfonamide
CID 64600885
N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-sulfonamide
CID 64601121
3-amino-4-bromo-N-(5-bromo-2-methylphenyl)benzenesulfonamide
CID 115328843

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide?
The IUPAC name of 6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide (CID 64602240) is 6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide?
The canonical SMILES for 6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide is Cc1ccc(Br)cc1NS(=O)(=O)c1cnc(N)c(Cl)c1.
What is the InChIKey of 6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide?
The InChIKey is XODJVICZEQVPPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrClN3O2S/c1-7-2-3-8(13)4-11(7)17-20(18,19)9-5-10(14)12(15)16-6-9/h2-6,17H,1H3,(H2,15,16).
What are the key properties of 6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide?
6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide has a molecular weight of 376.66 g/mol, XLogP of 3.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide is sourced from PubChem (CID 64602240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).