5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide

C17H14F4N2O2S — CID 22917315

IUPAC5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide
SMILESNS(=O)(=O)c1ccc(C2=C(c3ccc(F)cc3)CC(C(F)(F)F)C2)cn1
InChIInChI=1S/C17H14F4N2O2S/c18-13-4-1-10(2-5-13)14-7-12(17(19,20)21)8-15(14)11-3-6-16(23-9-11)26(22,24)25/h1-6,9,12H,7-8H2,(H2,22,24,25)
InChIKeyGGJRICNFMXZNQO-UHFFFAOYSA-N
MW386.37 g/mol
LogP3.75
Rot. Bonds3

About 5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide

5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide (PubChem CID 22917315) has the molecular formula C17H14F4N2O2S and a molecular weight of 386.37 g/mol. Its IUPAC name is 5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide
PubChem CID22917315
Molecular FormulaC17H14F4N2O2S
Molecular Weight386.37 g/mol
Exact Mass386.07
IUPAC Name5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide
SMILESNS(=O)(=O)c1ccc(C2=C(c3ccc(F)cc3)CC(C(F)(F)F)C2)cn1
InChIInChI=1S/C17H14F4N2O2S/c18-13-4-1-10(2-5-13)14-7-12(17(19,20)21)8-15(14)11-3-6-16(23-9-11)26(22,24)25/h1-6,9,12H,7-8H2,(H2,22,24,25)
InChIKeyGGJRICNFMXZNQO-UHFFFAOYSA-N
XLogP3.75
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.37
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2-(4-fluorophenyl)spiro[4.4]nona-1,3-dien-3-yl]pyridine-2-sulfonamide
CID 22907628
5-[2-(4-cyanophenyl)cyclopenten-1-yl]pyridine-2-sulfonamide
CID 22917300
4-[6-[6-(trifluoromethyl)-3-pyridinyl]spiro[2.4]hept-5-en-5-yl]benzenesulfonamide
CID 18933800
5-[2-(4-methylsulfanylphenyl)spiro[4.4]nona-1,3-dien-3-yl]pyridine-2-sulfonamide
CID 22907476
5-chloropyridine-2-sulfonamide
CID 22244571
2-(4-fluorophenyl)-1,3-thiazole-5-sulfonamide
CID 167475514
5-(2-cyclopentylethylsulfonylamino)pyridine-2-sulfonamide
CID 126833411
6-[4,4-diethyl-2-(4-fluorophenyl)cyclopenten-1-yl]pyridine-3-sulfonamide
CID 22917458
2-fluoro-5-[4-methyl-2-(4-methylsulfonylphenyl)cyclopenten-1-yl]pyridine
CID 22917570
4-[7-[6-(trifluoromethyl)-3-pyridinyl]spiro[3.4]oct-6-en-6-yl]benzenesulfonamide
CID 18933691
5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]pyridine-2-sulfonamide
CID 69352242
5-(4-oxocyclohexyl)pyridine-2-sulfonamide
CID 146640874

Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide?
The IUPAC name of 5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide (CID 22917315) is 5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide.
What is the SMILES notation for 5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide?
The canonical SMILES for 5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide is NS(=O)(=O)c1ccc(C2=C(c3ccc(F)cc3)CC(C(F)(F)F)C2)cn1.
What is the InChIKey of 5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide?
The InChIKey is GGJRICNFMXZNQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F4N2O2S/c18-13-4-1-10(2-5-13)14-7-12(17(19,20)21)8-15(14)11-3-6-16(23-9-11)26(22,24)25/h1-6,9,12H,7-8H2,(H2,22,24,25).
What are the key properties of 5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide?
5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide has a molecular weight of 386.37 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-fluorophenyl)-4-(trifluoromethyl)cyclopenten-1-yl]pyridine-2-sulfonamide is sourced from PubChem (CID 22917315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).