4-(trifluoromethoxy)pyridine-3-sulfonamide

C6H5F3N2O3S — CID 118829617

IUPAC4-(trifluoromethoxy)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cnccc1OC(F)(F)F
InChIInChI=1S/C6H5F3N2O3S/c7-6(8,9)14-4-1-2-11-3-5(4)15(10,12)13/h1-3H,(H2,10,12,13)
InChIKeyDLPCWUGDNRWBHJ-UHFFFAOYSA-N
MW242.18 g/mol
LogP0.63
Rot. Bonds2

About 4-(trifluoromethoxy)pyridine-3-sulfonamide

4-(trifluoromethoxy)pyridine-3-sulfonamide (PubChem CID 118829617) has the molecular formula C6H5F3N2O3S and a molecular weight of 242.18 g/mol. Its IUPAC name is 4-(trifluoromethoxy)pyridine-3-sulfonamide.

Molecular Properties

Compound Name4-(trifluoromethoxy)pyridine-3-sulfonamide
PubChem CID118829617
Molecular FormulaC6H5F3N2O3S
Molecular Weight242.18 g/mol
Exact Mass242.00
IUPAC Name4-(trifluoromethoxy)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cnccc1OC(F)(F)F
InChIInChI=1S/C6H5F3N2O3S/c7-6(8,9)14-4-1-2-11-3-5(4)15(10,12)13/h1-3H,(H2,10,12,13)
InChIKeyDLPCWUGDNRWBHJ-UHFFFAOYSA-N
XLogP0.63
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.18
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(trifluoromethoxy)pyridine-4-carboxamide
CID 130088898
5-iodo-2-(trifluoromethoxy)benzenesulfonamide
CID 170998338
3-(trifluoromethoxy)pyridine-4-carbonyl chloride
CID 130088891
3-propan-2-yl-4-(trifluoromethoxy)pyridine
CID 138513813
5-(4-methoxypyrimidin-5-yl)-2-(trifluoromethoxy)benzenesulfonamide
CID 167980928
3-cyano-4-(trifluoromethoxy)pyridine-2-sulfonamide
CID 133095483
2-(difluoromethyl)-3-(trifluoromethoxy)benzenesulfonamide
CID 170998891
5-hydroxy-4-methoxy-6-(trifluoromethoxy)pyridine-3-sulfonamide
CID 134665739
2,6-difluoro-4-[3-[3-methyl-4-(trifluoromethoxy)phenyl]-4-pyridinyl]benzenesulfonamide
CID 23090611
[4-[3-bromo-4-(trifluoromethoxy)phenoxy]-3-pyridinyl]methanol
CID 102714933
3-([1,3]thiazolo[4,5-f]isoquinolin-2-ylamino)-4-(trifluoromethoxy)benzenesulfonamide
CID 87944665
3-hydroxy-2-methyl-5-(trifluoromethoxy)pyridine-4-sulfonamide
CID 134664231

Frequently Asked Questions

What is the IUPAC name of 4-(trifluoromethoxy)pyridine-3-sulfonamide?
The IUPAC name of 4-(trifluoromethoxy)pyridine-3-sulfonamide (CID 118829617) is 4-(trifluoromethoxy)pyridine-3-sulfonamide.
What is the SMILES notation for 4-(trifluoromethoxy)pyridine-3-sulfonamide?
The canonical SMILES for 4-(trifluoromethoxy)pyridine-3-sulfonamide is NS(=O)(=O)c1cnccc1OC(F)(F)F.
What is the InChIKey of 4-(trifluoromethoxy)pyridine-3-sulfonamide?
The InChIKey is DLPCWUGDNRWBHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F3N2O3S/c7-6(8,9)14-4-1-2-11-3-5(4)15(10,12)13/h1-3H,(H2,10,12,13).
What are the key properties of 4-(trifluoromethoxy)pyridine-3-sulfonamide?
4-(trifluoromethoxy)pyridine-3-sulfonamide has a molecular weight of 242.18 g/mol, XLogP of 0.63, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(trifluoromethoxy)pyridine-3-sulfonamide is sourced from PubChem (CID 118829617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).