5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide

C9H10BrN5O2S — CID 83167706

IUPAC5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide
SMILESCc1cc(Br)cnc1NS(=O)(=O)c1cn[nH]c1N
InChIInChI=1S/C9H10BrN5O2S/c1-5-2-6(10)3-12-9(5)15-18(16,17)7-4-13-14-8(7)11/h2-4H,1H3,(H,12,15)(H3,11,13,14)
InChIKeyKTJXUOYSBQEGQC-UHFFFAOYSA-N
MW332.18 g/mol
LogP1.26
Rot. Bonds3

About 5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide

5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide (PubChem CID 83167706) has the molecular formula C9H10BrN5O2S and a molecular weight of 332.18 g/mol. Its IUPAC name is 5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound Name5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide
PubChem CID83167706
Molecular FormulaC9H10BrN5O2S
Molecular Weight332.18 g/mol
Exact Mass330.97
IUPAC Name5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide
SMILESCc1cc(Br)cnc1NS(=O)(=O)c1cn[nH]c1N
InChIInChI=1S/C9H10BrN5O2S/c1-5-2-6(10)3-12-9(5)15-18(16,17)7-4-13-14-8(7)11/h2-4H,1H3,(H,12,15)(H3,11,13,14)
InChIKeyKTJXUOYSBQEGQC-UHFFFAOYSA-N
XLogP1.26
TPSA113.76 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.18
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-(5-bromo-3-methyl-2-pyridinyl)-4,5-dimethylbenzenesulfonamide
CID 83166245
5-amino-N-(4-bromo-2-methylphenyl)-1H-pyrazole-4-sulfonamide
CID 54922704
5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-2,3-dimethylbenzenesulfonamide
CID 83165910
5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-2,4-difluorobenzenesulfonamide
CID 83166077
2-amino-N-(5-bromo-3-methyl-2-pyridinyl)pyrimidine-5-sulfonamide
CID 83170644
2,5-dibromo-N-(5-bromo-3-methyl-2-pyridinyl)benzenesulfonamide
CID 83170783
2-amino-N-(5-bromo-3-methyl-2-pyridinyl)-3,6-dimethylbenzenesulfonamide
CID 103171723
5-amino-N-(3,5-dimethylphenyl)-1H-pyrazole-4-sulfonamide
CID 60815176
4-amino-3-bromo-N-(5-bromo-3-methyl-2-pyridinyl)benzenesulfonamide
CID 83167153
4-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-chlorobenzenesulfonamide
CID 81421854
3-amino-N-(5-bromo-3-methyl-2-pyridinyl)-4-methylbenzenesulfonamide
CID 83166969
N-(5-bromo-3-methyl-2-pyridinyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 81422363

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of 5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide (CID 83167706) is 5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for 5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for 5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide is Cc1cc(Br)cnc1NS(=O)(=O)c1cn[nH]c1N.
What is the InChIKey of 5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide?
The InChIKey is KTJXUOYSBQEGQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrN5O2S/c1-5-2-6(10)3-12-9(5)15-18(16,17)7-4-13-14-8(7)11/h2-4H,1H3,(H,12,15)(H3,11,13,14).
What are the key properties of 5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide?
5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide has a molecular weight of 332.18 g/mol, XLogP of 1.26, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(5-bromo-3-methyl-2-pyridinyl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 83167706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).