6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide

C62H37F10N15O10S4 — CID 159138432

IUPAC6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)Nc2cc(F)cc3cccnc23)cn1.N#Cc1ccc(S(=O)(=O)Nc2cc(OC(F)(F)F)cc3cccnc23)cn1.N#Cc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)c3cccnc23)cn1.O=S(=O)(Nc1cc(OC(F)(F)F)cc2cccnc12)c1cccnc1
InChIInChI=1S/C16H9F3N4O3S.C16H9F3N4O2S.C15H10F3N3O3S.C15H9FN4O2S/c17-16(18,19)26-12-6-10-2-1-5-21-15(10)14(7-12)23-27(24,25)13-4-3-11(8-20)22-9-13;17-16(18,19)13-5-6-14(15-12(13)2-1-7-21-15)23-26(24,25)11-4-3-10(8-20)22-9-11;16-15(17,18)24-11-7-10-3-1-6-20-14(10)13(8-11)21-25(22,23)12-4-2-5-19-9-12;16-11-6-10-2-1-5-18-15(10)14(7-11)20-23(21,22)13-4-3-12(8-17)19-9-13/h1-7,9,23H;1-7,9,23H;1-9,21H;1-7,9,20H
InChIKeyKHUHXXXSIPZKLT-UHFFFAOYSA-N
MW1470.32 g/mol
LogP12.29
Rot. Bonds14

About 6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide

6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide (PubChem CID 159138432) has the molecular formula C62H37F10N15O10S4 and a molecular weight of 1470.32 g/mol. Its IUPAC name is 6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide
PubChem CID159138432
Molecular FormulaC62H37F10N15O10S4
Molecular Weight1470.32 g/mol
Exact Mass1469.16
IUPAC Name6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)Nc2cc(F)cc3cccnc23)cn1.N#Cc1ccc(S(=O)(=O)Nc2cc(OC(F)(F)F)cc3cccnc23)cn1.N#Cc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)c3cccnc23)cn1.O=S(=O)(Nc1cc(OC(F)(F)F)cc2cccnc12)c1cccnc1
InChIInChI=1S/C16H9F3N4O3S.C16H9F3N4O2S.C15H10F3N3O3S.C15H9FN4O2S/c17-16(18,19)26-12-6-10-2-1-5-21-15(10)14(7-12)23-27(24,25)13-4-3-11(8-20)22-9-13;17-16(18,19)13-5-6-14(15-12(13)2-1-7-21-15)23-26(24,25)11-4-3-10(8-20)22-9-11;16-15(17,18)24-11-7-10-3-1-6-20-14(10)13(8-11)21-25(22,23)12-4-2-5-19-9-12;16-11-6-10-2-1-5-18-15(10)14(7-11)20-23(21,22)13-4-3-12(8-17)19-9-13/h1-7,9,23H;1-7,9,23H;1-9,21H;1-7,9,20H
InChIKeyKHUHXXXSIPZKLT-UHFFFAOYSA-N
XLogP12.29
TPSA377.63 Ų
H-Bond Donors4
H-Bond Acceptors21
Rotatable Bonds14
Heavy Atoms101
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001470.32
LogP ≤ 512.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1021

Analyze 6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide with MolForge

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Related Compounds

6-Cyano-pyridine-3-sulfonic acid (6-trifluoromethoxy-quinolin-8-yl)-amide
CID 60164305
Pyridine-3-sulfonic acid (6-trifluoromethoxy-quinolin-8-yl)-amide
CID 68190278
6-Trifluoromethyl-pyridine-3-sulfonic acid (6-trifluoromethoxy-quinolin-8-yl)-amide
CID 60164192
3-cyano-4-fluoro-N-(6-phenylmethoxy-8-quinolinyl)benzenesulfonamide
CID 16072247
6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfinamide
CID 126516518
N-[6-(trifluoromethoxy)quinolin-8-yl]-6-(trifluoromethyl)pyridine-3-sulfinamide
CID 126516520
N-(6-fluoroquinolin-8-yl)pyridine-2-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-2-sulfonamide;N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-2-sulfonamide;6-(trifluoromethyl)-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide
CID 157917089
8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;11-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;1-methoxy-9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;12-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
CID 158715901
2-amino-N-(5-chloroquinolin-8-yl)-4-methylbenzenesulfonamide;2-amino-N-(6-methoxyquinolin-8-yl)-4-methylbenzenesulfonamide;N-(5,6-dimethylquinolin-8-yl)benzenesulfonamide;N-(6-fluoroquinolin-8-yl)benzenesulfonamide;N-(6-methylquinolin-8-yl)benzenesulfonamide;9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
CID 159223835
N-(4-methoxyquinolin-8-yl)benzenesulfonamide;N-(5-methylquinolin-8-yl)benzenesulfonamide;N-quinolin-8-ylquinoline-3-sulfonamide;N-quinolin-8-yl-6-(trifluoromethyl)pyridine-3-sulfonamide;N-[5-(trifluoromethyl)quinolin-8-yl]benzenesulfonamide
CID 160260945
8,9-dimethyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-fluoro-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;methane;9-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;3-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;5-methylquinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide;9-(trifluoromethyl)-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
CID 161082210
6-methyl-N-quinolin-8-ylpyridine-2-sulfonamide;N-quinolin-8-ylpyrazine-2-sulfonamide;N-quinolin-8-yl-1,3-thiazole-2-sulfonamide;N-quinolin-8-yl-5-(trifluoromethyl)pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]-6-(trifluoromethyl)pyridine-3-sulfonamide
CID 161951973

Frequently Asked Questions

What is the IUPAC name of 6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide?
The IUPAC name of 6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide (CID 159138432) is 6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide.
What is the SMILES notation for 6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide?
The canonical SMILES for 6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide is N#Cc1ccc(S(=O)(=O)Nc2cc(F)cc3cccnc23)cn1.N#Cc1ccc(S(=O)(=O)Nc2cc(OC(F)(F)F)cc3cccnc23)cn1.N#Cc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)c3cccnc23)cn1.O=S(=O)(Nc1cc(OC(F)(F)F)cc2cccnc12)c1cccnc1.
What is the InChIKey of 6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide?
The InChIKey is KHUHXXXSIPZKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9F3N4O3S.C16H9F3N4O2S.C15H10F3N3O3S.C15H9FN4O2S/c17-16(18,19)26-12-6-10-2-1-5-21-15(10)14(7-12)23-27(24,25)13-4-3-11(8-20)22-9-13;17-16(18,19)13-5-6-14(15-12(13)2-1-7-21-15)23-26(24,25)11-4-3-10(8-20)22-9-11;16-15(17,18)24-11-7-10-3-1-6-20-14(10)13(8-11)21-25(22,23)12-4-2-5-19-9-12;16-11-6-10-2-1-5-18-15(10)14(7-11)20-23(21,22)13-4-3-12(8-17)19-9-13/h1-7,9,23H;1-7,9,23H;1-9,21H;1-7,9,20H.
What are the key properties of 6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide?
6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide has a molecular weight of 1470.32 g/mol, XLogP of 12.29, 14 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyano-N-(6-fluoroquinolin-8-yl)pyridine-3-sulfonamide;6-cyano-N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide;6-cyano-N-[5-(trifluoromethyl)quinolin-8-yl]pyridine-3-sulfonamide;N-[6-(trifluoromethoxy)quinolin-8-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 159138432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).