3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide

C7H7BrF2N2O2S — CID 130069661

IUPAC3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide
SMILESCc1nc(C(F)F)cc(S(N)(=O)=O)c1Br
InChIInChI=1S/C7H7BrF2N2O2S/c1-3-6(8)5(15(11,13)14)2-4(12-3)7(9)10/h2,7H,1H3,(H2,11,13,14)
InChIKeyPSXXYAOPVWVMOJ-UHFFFAOYSA-N
MW301.11 g/mol
LogP1.74
Rot. Bonds2

About 3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide

3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide (PubChem CID 130069661) has the molecular formula C7H7BrF2N2O2S and a molecular weight of 301.11 g/mol. Its IUPAC name is 3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide.

Molecular Properties

Compound Name3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide
PubChem CID130069661
Molecular FormulaC7H7BrF2N2O2S
Molecular Weight301.11 g/mol
Exact Mass299.94
IUPAC Name3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide
SMILESCc1nc(C(F)F)cc(S(N)(=O)=O)c1Br
InChIInChI=1S/C7H7BrF2N2O2S/c1-3-6(8)5(15(11,13)14)2-4(12-3)7(9)10/h2,7H,1H3,(H2,11,13,14)
InChIKeyPSXXYAOPVWVMOJ-UHFFFAOYSA-N
XLogP1.74
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.11
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(difluoromethyl)-3-iodo-2-methylpyridine-4-sulfonamide
CID 130086431
6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide
CID 133098978
5-bromo-2-(difluoromethyl)pyridine-4-sulfonamide
CID 130095357
3-amino-6-(difluoromethyl)-2-fluoropyridine-4-sulfonamide
CID 130104467
4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonamide
CID 118839782
3-chloro-6-(difluoromethyl)-2-methylpyridine-4-sulfonyl chloride
CID 130074580
6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide
CID 133105136
2-amino-4-bromo-6-(difluoromethyl)pyridine-3-sulfonamide
CID 130102336
4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide
CID 118850937
2-amino-6-(difluoromethyl)-4-methylpyridine-3-sulfonamide
CID 118995995
3-amino-6-(difluoromethyl)-4-methylpyridine-2-sulfonamide
CID 130106771
2-chloro-3-cyano-6-(difluoromethyl)pyridine-4-sulfonamide
CID 119017925

Frequently Asked Questions

What is the IUPAC name of 3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide?
The IUPAC name of 3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide (CID 130069661) is 3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide.
What is the SMILES notation for 3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide?
The canonical SMILES for 3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide is Cc1nc(C(F)F)cc(S(N)(=O)=O)c1Br.
What is the InChIKey of 3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide?
The InChIKey is PSXXYAOPVWVMOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrF2N2O2S/c1-3-6(8)5(15(11,13)14)2-4(12-3)7(9)10/h2,7H,1H3,(H2,11,13,14).
What are the key properties of 3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide?
3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide has a molecular weight of 301.11 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-6-(difluoromethyl)-2-methylpyridine-4-sulfonamide is sourced from PubChem (CID 130069661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).