N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide

C15H11F3N4O2S — CID 166211989

IUPACN-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cnn(-c2ccccn2)c1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H11F3N4O2S/c16-15(17,18)11-4-6-13(7-5-11)25(23,24)21-12-9-20-22(10-12)14-3-1-2-8-19-14/h1-10,21H
InChIKeyZFHUHTCRGULYBR-UHFFFAOYSA-N
MW368.34 g/mol
LogP3.09
Rot. Bonds4

About N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide

N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide (PubChem CID 166211989) has the molecular formula C15H11F3N4O2S and a molecular weight of 368.34 g/mol. Its IUPAC name is N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide
PubChem CID166211989
Molecular FormulaC15H11F3N4O2S
Molecular Weight368.34 g/mol
Exact Mass368.06
IUPAC NameN-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cnn(-c2ccccn2)c1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H11F3N4O2S/c16-15(17,18)11-4-6-13(7-5-11)25(23,24)21-12-9-20-22(10-12)14-3-1-2-8-19-14/h1-10,21H
InChIKeyZFHUHTCRGULYBR-UHFFFAOYSA-N
XLogP3.09
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.34
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-fluorophenyl)-1-pyridin-2-ylpyrazole-4-sulfonamide
CID 71688105
N-(2-pyridin-2-yl-1,5-dihydropyrazol-3-yl)-4-(trifluoromethyl)benzenesulfonamide
CID 163635019
N-(2-fluorophenyl)-1-pyridin-2-ylpyrazole-4-sulfonamide
CID 71688101
N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-sulfonamide
CID 71688094
2-amino-N-(1-pyridin-2-ylpyrazol-4-yl)-5-(trifluoromethyl)benzamide
CID 118427664
N-(2-chloro-4-pyridinyl)-4-(trifluoromethyl)benzenesulfonamide
CID 103944025
N-(2-methoxypyrimidin-5-yl)-4-(trifluoromethyl)benzenesulfonamide
CID 91968408
N-(2,4-dimethylphenyl)-1-pyridin-2-ylpyrazole-4-sulfonamide
CID 71688083
4-chloro-N-[1-(1-phenylpyrazol-4-yl)pyrazol-4-yl]benzenesulfonamide
CID 17383692
N-pyridin-2-yl-4-[[3-(trifluoromethyl)phenyl]sulfamoyl]benzamide
CID 24538181
N-(1-ethylpyrazol-3-yl)-1-pyridin-2-ylpyrazole-4-sulfonamide
CID 71688053
2-[4-[4-(trifluoromethyl)phenyl]triazol-1-yl]pyridine
CID 122389020

Frequently Asked Questions

What is the IUPAC name of N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide?
The IUPAC name of N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide (CID 166211989) is N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide.
What is the SMILES notation for N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide?
The canonical SMILES for N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide is O=S(=O)(Nc1cnn(-c2ccccn2)c1)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide?
The InChIKey is ZFHUHTCRGULYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3N4O2S/c16-15(17,18)11-4-6-13(7-5-11)25(23,24)21-12-9-20-22(10-12)14-3-1-2-8-19-14/h1-10,21H.
What are the key properties of N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide?
N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide has a molecular weight of 368.34 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyridin-2-ylpyrazol-4-yl)-4-(trifluoromethyl)benzenesulfonamide is sourced from PubChem (CID 166211989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).