2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide

C11H8BrFN2O3S — CID 112573154

IUPAC2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnc1Oc1ccc(F)c(Br)c1
InChIInChI=1S/C11H8BrFN2O3S/c12-8-6-7(3-4-9(8)13)18-11-10(19(14,16)17)2-1-5-15-11/h1-6H,(H2,14,16,17)
InChIKeyVJYNXNFHDDHUOU-UHFFFAOYSA-N
MW347.17 g/mol
LogP2.42
Rot. Bonds3

About 2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide

2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide (PubChem CID 112573154) has the molecular formula C11H8BrFN2O3S and a molecular weight of 347.17 g/mol. Its IUPAC name is 2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide
PubChem CID112573154
Molecular FormulaC11H8BrFN2O3S
Molecular Weight347.17 g/mol
Exact Mass345.94
IUPAC Name2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnc1Oc1ccc(F)c(Br)c1
InChIInChI=1S/C11H8BrFN2O3S/c12-8-6-7(3-4-9(8)13)18-11-10(19(14,16)17)2-1-5-15-11/h1-6H,(H2,14,16,17)
InChIKeyVJYNXNFHDDHUOU-UHFFFAOYSA-N
XLogP2.42
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.17
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,4-difluorophenoxy)pyridine-3-sulfonamide
CID 112573012
2-(4-methoxyphenoxy)pyridine-3-sulfonamide
CID 112572912
2-(3-bromo-4-fluorophenoxy)-3-chloropyridine
CID 83234949
2-(3-tert-butylphenoxy)pyridine-3-sulfonamide
CID 115928484
2-(4-methylsulfonylphenoxy)pyridine-3-sulfonamide
CID 115928497
2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide
CID 112573090
2-(2-methoxyphenoxy)pyridine-3-sulfonamide
CID 112572908
2-(2,5-dimethylphenoxy)pyridine-3-sulfonamide
CID 112572887
2-(3-fluoro-4-methylphenoxy)pyridine-3-sulfonyl chloride
CID 107168534
2-(2-bromo-4-methoxyphenoxy)-3-fluoropyridine
CID 104707654
2-(4-bromo-2-propan-2-ylphenoxy)pyridine-3-sulfonamide
CID 115928526
2-fluoro-6-[(3-sulfamoyl-2-pyridinyl)oxy]benzamide
CID 115928496

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide?
The IUPAC name of 2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide (CID 112573154) is 2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide.
What is the SMILES notation for 2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide?
The canonical SMILES for 2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide is NS(=O)(=O)c1cccnc1Oc1ccc(F)c(Br)c1.
What is the InChIKey of 2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide?
The InChIKey is VJYNXNFHDDHUOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrFN2O3S/c12-8-6-7(3-4-9(8)13)18-11-10(19(14,16)17)2-1-5-15-11/h1-6H,(H2,14,16,17).
What are the key properties of 2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide?
2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide has a molecular weight of 347.17 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-4-fluorophenoxy)pyridine-3-sulfonamide is sourced from PubChem (CID 112573154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).