4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide

C16H12F3N3O2S — CID 171466493

IUPAC4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide
SMILESCc1cc(C(F)(F)F)ncc1S(=O)(=O)Nc1cccc2cccnc12
InChIInChI=1S/C16H12F3N3O2S/c1-10-8-14(16(17,18)19)21-9-13(10)25(23,24)22-12-6-2-4-11-5-3-7-20-15(11)12/h2-9,22H,1H3
InChIKeyKZPFWWUBUIAURU-UHFFFAOYSA-N
MW367.35 g/mol
LogP3.76
Rot. Bonds3

About 4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide

4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide (PubChem CID 171466493) has the molecular formula C16H12F3N3O2S and a molecular weight of 367.35 g/mol. Its IUPAC name is 4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide
PubChem CID171466493
Molecular FormulaC16H12F3N3O2S
Molecular Weight367.35 g/mol
Exact Mass367.06
IUPAC Name4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide
SMILESCc1cc(C(F)(F)F)ncc1S(=O)(=O)Nc1cccc2cccnc12
InChIInChI=1S/C16H12F3N3O2S/c1-10-8-14(16(17,18)19)21-9-13(10)25(23,24)22-12-6-2-4-11-5-3-7-20-15(11)12/h2-9,22H,1H3
InChIKeyKZPFWWUBUIAURU-UHFFFAOYSA-N
XLogP3.76
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.35
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-quinolin-8-yl-2-(trifluoromethyl)pyridine-3-sulfonamide
CID 171466436
2-chloro-4-methyl-N-quinolin-8-ylbenzenesulfonamide
CID 24629216
N-[[6-(trifluoromethyl)-3-pyridinyl]sulfonylmethyl]quinolin-8-amine
CID 162569376
2-hydroxy-N-quinolin-8-ylbenzenesulfonamide
CID 1380884
4-iodo-N-quinolin-8-ylbenzenesulfonamide
CID 25048748
2-chloro-N-quinolin-8-ylpyridine-3-sulfonamide
CID 24621400
2,2,2-tris[2-(quinolin-8-ylsulfamoyl)-5-(trifluoromethyl)phenyl]acetamide
CID 150376480
N-(2,4-dimethylphenyl)quinoline-8-sulfonamide
CID 4067742
2-ethoxy-4-methyl-N-quinolin-8-ylbenzenesulfonamide
CID 76506701
2-ethoxy-4-methyl-5-propan-2-yl-N-quinolin-8-ylbenzenesulfonamide
CID 136574217
6-amino-N-quinolin-8-ylpyridine-3-sulfonamide
CID 62164738
3-ethenyl-2-fluoro-N-quinolin-8-ylbenzenesulfonamide
CID 126516495

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide?
The IUPAC name of 4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide (CID 171466493) is 4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide?
The canonical SMILES for 4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide is Cc1cc(C(F)(F)F)ncc1S(=O)(=O)Nc1cccc2cccnc12.
What is the InChIKey of 4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide?
The InChIKey is KZPFWWUBUIAURU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F3N3O2S/c1-10-8-14(16(17,18)19)21-9-13(10)25(23,24)22-12-6-2-4-11-5-3-7-20-15(11)12/h2-9,22H,1H3.
What are the key properties of 4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide?
4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide has a molecular weight of 367.35 g/mol, XLogP of 3.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 171466493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).