6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide

C8H9F3N2O4S — CID 134669634

IUPAC6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide
SMILESCOc1nc(S(N)(=O)=O)cc(C)c1OC(F)(F)F
InChIInChI=1S/C8H9F3N2O4S/c1-4-3-5(18(12,14)15)13-7(16-2)6(4)17-8(9,10)11/h3H,1-2H3,(H2,12,14,15)
InChIKeyBZDPJJPTGSFFKK-UHFFFAOYSA-N
MW286.23 g/mol
LogP0.94
Rot. Bonds3

About 6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide

6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide (PubChem CID 134669634) has the molecular formula C8H9F3N2O4S and a molecular weight of 286.23 g/mol. Its IUPAC name is 6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide.

Molecular Properties

Compound Name6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide
PubChem CID134669634
Molecular FormulaC8H9F3N2O4S
Molecular Weight286.23 g/mol
Exact Mass286.02
IUPAC Name6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide
SMILESCOc1nc(S(N)(=O)=O)cc(C)c1OC(F)(F)F
InChIInChI=1S/C8H9F3N2O4S/c1-4-3-5(18(12,14)15)13-7(16-2)6(4)17-8(9,10)11/h3H,1-2H3,(H2,12,14,15)
InChIKeyBZDPJJPTGSFFKK-UHFFFAOYSA-N
XLogP0.94
TPSA91.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.23
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-bromo-6-fluoro-5-(trifluoromethoxy)pyridine-2-sulfonamide
CID 118838899
6-methoxy-2-methyl-5-(trifluoromethoxy)pyridine-3-sulfonamide
CID 134679348
4-amino-2-methoxy-6-(trifluoromethoxy)pyridine-3-sulfonamide
CID 118840565
5-hydroxy-3-methoxy-6-(trifluoromethoxy)pyridine-2-sulfonamide
CID 134659583
6-methoxy-5-methyl-4-(trifluoromethoxy)pyridine-2-sulfonyl chloride
CID 131315423
3-hydroxy-6-methoxy-5-(trifluoromethoxy)pyridine-2-sulfonamide
CID 134659587
5-nitro-6-(trifluoromethoxy)-4-(trifluoromethyl)pyridine-2-sulfonamide
CID 134669008
4-(difluoromethyl)-5-hydroxy-6-methoxypyridine-2-sulfonamide
CID 118801223
5-methoxy-4-methyl-6-(trifluoromethoxy)pyridine-2-carbonyl chloride
CID 134679365
4-methoxy-5-methyl-6-(trifluoromethoxy)pyridine-2-sulfonyl chloride
CID 131319656
4-methoxy-3-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide
CID 134660596
6-(difluoromethyl)-3-methoxy-4-methyl-2-(trifluoromethoxy)pyridine
CID 134678577

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide?
The IUPAC name of 6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide (CID 134669634) is 6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide.
What is the SMILES notation for 6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide?
The canonical SMILES for 6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide is COc1nc(S(N)(=O)=O)cc(C)c1OC(F)(F)F.
What is the InChIKey of 6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide?
The InChIKey is BZDPJJPTGSFFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F3N2O4S/c1-4-3-5(18(12,14)15)13-7(16-2)6(4)17-8(9,10)11/h3H,1-2H3,(H2,12,14,15).
What are the key properties of 6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide?
6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide has a molecular weight of 286.23 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-methyl-5-(trifluoromethoxy)pyridine-2-sulfonamide is sourced from PubChem (CID 134669634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).