2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide

C12H11BrFN3O2S — CID 62162619

IUPAC2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide
SMILESCc1ccc(NS(=O)(=O)c2cc(Br)cnc2N)c(F)c1
InChIInChI=1S/C12H11BrFN3O2S/c1-7-2-3-10(9(14)4-7)17-20(18,19)11-5-8(13)6-16-12(11)15/h2-6,17H,1H3,(H2,15,16)
InChIKeyALQSIDOSDVHQLB-UHFFFAOYSA-N
MW360.21 g/mol
LogP2.67
Rot. Bonds3

About 2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide

2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide (PubChem CID 62162619) has the molecular formula C12H11BrFN3O2S and a molecular weight of 360.21 g/mol. Its IUPAC name is 2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide
PubChem CID62162619
Molecular FormulaC12H11BrFN3O2S
Molecular Weight360.21 g/mol
Exact Mass358.97
IUPAC Name2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide
SMILESCc1ccc(NS(=O)(=O)c2cc(Br)cnc2N)c(F)c1
InChIInChI=1S/C12H11BrFN3O2S/c1-7-2-3-10(9(14)4-7)17-20(18,19)11-5-8(13)6-16-12(11)15/h2-6,17H,1H3,(H2,15,16)
InChIKeyALQSIDOSDVHQLB-UHFFFAOYSA-N
XLogP2.67
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.21
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-5-bromo-N-(2-chloro-4-methylphenyl)pyridine-3-sulfonamide
CID 22515878
2-amino-5-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)pyridine-3-sulfonamide
CID 107593897
2-amino-5-bromo-N-(4-bromo-2,5-difluorophenyl)pyridine-3-sulfonamide
CID 103844082
2-amino-5-bromo-N-(5-fluoro-2-methylphenyl)pyridine-3-sulfonamide
CID 62143669
2-amino-5-bromo-N-(2-methylsulfanylphenyl)pyridine-3-sulfonamide
CID 103766525
2-amino-5-bromo-N-(3,4,5-trifluorophenyl)pyridine-3-sulfonamide
CID 62813648
2-amino-5-bromo-N-(2,6-dimethylphenyl)pyridine-3-sulfonamide
CID 22515848
2-amino-5-bromo-N-(4-bromo-2,6-dimethylphenyl)pyridine-3-sulfonamide
CID 62163149
2-amino-5-bromo-N-(2,4-dimethoxyphenyl)pyridine-3-sulfonamide
CID 22515844
4-bromo-2-chloro-N-(2-fluoro-4-methylphenyl)benzenesulfonamide
CID 26979434
2-amino-5-bromo-N-(2-bromo-5-chloro-4-methylphenyl)pyridine-3-sulfonamide
CID 104725117
5-bromo-N-(2-fluoro-4-methylphenyl)thiophene-2-sulfonamide
CID 8523278

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide?
The IUPAC name of 2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide (CID 62162619) is 2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide is Cc1ccc(NS(=O)(=O)c2cc(Br)cnc2N)c(F)c1.
What is the InChIKey of 2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide?
The InChIKey is ALQSIDOSDVHQLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrFN3O2S/c1-7-2-3-10(9(14)4-7)17-20(18,19)11-5-8(13)6-16-12(11)15/h2-6,17H,1H3,(H2,15,16).
What are the key properties of 2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide?
2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide has a molecular weight of 360.21 g/mol, XLogP of 2.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-N-(2-fluoro-4-methylphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 62162619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).