2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide

C9H7F3N4O2S — CID 175751887

IUPAC2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnc1-n1cc(C(F)(F)F)cn1
InChIInChI=1S/C9H7F3N4O2S/c10-9(11,12)6-4-15-16(5-6)8-7(19(13,17)18)2-1-3-14-8/h1-5H,(H2,13,17,18)
InChIKeyQEKABKYZUAJYIU-UHFFFAOYSA-N
MW292.24 g/mol
LogP0.93
Rot. Bonds2

About 2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide

2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide (PubChem CID 175751887) has the molecular formula C9H7F3N4O2S and a molecular weight of 292.24 g/mol. Its IUPAC name is 2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
PubChem CID175751887
Molecular FormulaC9H7F3N4O2S
Molecular Weight292.24 g/mol
Exact Mass292.02
IUPAC Name2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnc1-n1cc(C(F)(F)F)cn1
InChIInChI=1S/C9H7F3N4O2S/c10-9(11,12)6-4-15-16(5-6)8-7(19(13,17)18)2-1-3-14-8/h1-5H,(H2,13,17,18)
InChIKeyQEKABKYZUAJYIU-UHFFFAOYSA-N
XLogP0.93
TPSA90.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.24
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-N'-[[2-[4-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]sulfonyl]methanimidamide
CID 175263598
(1R)-1-[2-[4-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]ethanamine
CID 114056524
5-(benzhydrylideneamino)-2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
CID 138559643
3-[4-(trifluoromethyl)pyrazol-1-yl]pyrazin-2-amine
CID 102988586
6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
CID 170964811
1-[4-(trifluoromethyl)-2-pyridinyl]pyrazole-4-sulfonamide
CID 170968677
5-bromo-4-[4-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-amine
CID 80868730
2-[5-[4-(furan-2-yl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide
CID 22313838
3-ethylsulfonyl-2-(4-iodopyrazol-1-yl)-5-(trifluoromethyl)pyridine
CID 121485081
2-[3-sulfamoyl-2-(trifluoromethyl)-4-[4-(trifluoromethyl)pyrazol-1-yl]phenyl]acetamide
CID 175751841
3-(1,1,2,2,2-pentafluoroethyl)-2-pyrazol-1-ylbenzenesulfonamide
CID 22415506
1-(3-chlorophenyl)-4-(trifluoromethyl)pyrazole
CID 84803212

Frequently Asked Questions

What is the IUPAC name of 2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide?
The IUPAC name of 2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide (CID 175751887) is 2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide?
The canonical SMILES for 2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide is NS(=O)(=O)c1cccnc1-n1cc(C(F)(F)F)cn1.
What is the InChIKey of 2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide?
The InChIKey is QEKABKYZUAJYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F3N4O2S/c10-9(11,12)6-4-15-16(5-6)8-7(19(13,17)18)2-1-3-14-8/h1-5H,(H2,13,17,18).
What are the key properties of 2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide?
2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide has a molecular weight of 292.24 g/mol, XLogP of 0.93, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 175751887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).