5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane

C41H32Cl4F8N6O7S2 — CID 159433012

IUPAC5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane
SMILESC.CN(C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1cccc(F)c1.CNc1cccc(F)c1.O=C(O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1
InChIInChI=1S/C20H13Cl2F4N3O3S.C13H7Cl2F3N2O4S.C7H8FN.CH4/c1-29(13-4-2-3-12(23)8-13)19(30)18-17(7-11(21)10-27-18)28-33(31,32)14-5-6-16(22)15(9-14)20(24,25)26;14-6-3-10(11(12(21)22)19-5-6)20-25(23,24)7-1-2-9(15)8(4-7)13(16,17)18;1-9-7-4-2-3-6(8)5-7;/h2-10,28H,1H3;1-5,20H,(H,21,22);2-5,9H,1H3;1H4
InChIKeyLRFKZNRGPAXCNP-UHFFFAOYSA-N
MW1078.67 g/mol
LogP12.03
Rot. Bonds10

About 5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane

5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane (PubChem CID 159433012) has the molecular formula C41H32Cl4F8N6O7S2 and a molecular weight of 1078.67 g/mol. Its IUPAC name is 5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane.

Molecular Properties

Compound Name5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane
PubChem CID159433012
Molecular FormulaC41H32Cl4F8N6O7S2
Molecular Weight1078.67 g/mol
Exact Mass1076.04
IUPAC Name5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane
SMILESC.CN(C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1cccc(F)c1.CNc1cccc(F)c1.O=C(O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1
InChIInChI=1S/C20H13Cl2F4N3O3S.C13H7Cl2F3N2O4S.C7H8FN.CH4/c1-29(13-4-2-3-12(23)8-13)19(30)18-17(7-11(21)10-27-18)28-33(31,32)14-5-6-16(22)15(9-14)20(24,25)26;14-6-3-10(11(12(21)22)19-5-6)20-25(23,24)7-1-2-9(15)8(4-7)13(16,17)18;1-9-7-4-2-3-6(8)5-7;/h2-10,28H,1H3;1-5,20H,(H,21,22);2-5,9H,1H3;1H4
InChIKeyLRFKZNRGPAXCNP-UHFFFAOYSA-N
XLogP12.03
TPSA187.76 Ų
H-Bond Donors4
H-Bond Acceptors9
Rotatable Bonds10
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001078.67
LogP ≤ 512.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 109

Analyze 5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane with MolForge

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Related Compounds

4-chloro-N-[5-chloro-2-[2-(methylamino)benzoyl]-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide
CID 143262645
2-[5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carbonyl]-3-methylbenzoic acid
CID 11635148
5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylmethoxymethylamino]-N-methyl-N-phenylpyridine-2-carboxamide
CID 66648866
4-chloro-N-[5-chloro-2-(3-methylbenzoyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide
CID 11554926
2-[5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carbonyl]benzoic acid;methane;methyl 2-[5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carbonyl]benzoate
CID 159754215
4-chloro-N-[5-chloro-2-(pyridine-4-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide
CID 11591022
5-chloro-3-[[4-chloro-3-(1,1-difluoroethyl)phenyl]sulfonylamino]-N-phenylpyridine-2-carboxamide
CID 143262651
5-chloro-3-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(2,4-difluorophenyl)-N-methylpyridine-2-carboxamide
CID 58268152
4-chloro-N-(5-chloro-2-methoxy-3-pyridinyl)-3-(trifluoromethyl)benzenesulfonamide
CID 67227108
3-bromo-N-[5-chloro-2-(2-fluoro-6-methoxybenzoyl)-3-pyridinyl]-4-(trifluoromethyl)benzenesulfonamide
CID 11699761
3-chloro-N-[5-chloro-2-[2-methyl-6-[methyl(methylsulfonyl)amino]benzoyl]-3-pyridinyl]-4-(trifluoromethyl)benzenesulfonamide
CID 11512719
4-chloro-N-[5-chloro-2-(8-fluoro-2,3-dihydro-1,4-benzoxazine-4-carbonyl)-3-pyridinyl]-3-(trifluoromethyl)benzenesulfonamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;8-fluoro-3,4-dihydro-2H-1,4-benzoxazine
CID 160606909

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane?
The IUPAC name of 5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane (CID 159433012) is 5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane.
What is the SMILES notation for 5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane?
The canonical SMILES for 5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane is C.CN(C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1cccc(F)c1.CNc1cccc(F)c1.O=C(O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.
What is the InChIKey of 5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane?
The InChIKey is LRFKZNRGPAXCNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13Cl2F4N3O3S.C13H7Cl2F3N2O4S.C7H8FN.CH4/c1-29(13-4-2-3-12(23)8-13)19(30)18-17(7-11(21)10-27-18)28-33(31,32)14-5-6-16(22)15(9-14)20(24,25)26;14-6-3-10(11(12(21)22)19-5-6)20-25(23,24)7-1-2-9(15)8(4-7)13(16,17)18;1-9-7-4-2-3-6(8)5-7;/h2-10,28H,1H3;1-5,20H,(H,21,22);2-5,9H,1H3;1H4.
What are the key properties of 5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane?
5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane has a molecular weight of 1078.67 g/mol, XLogP of 12.03, 10 rotatable bonds, 4 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(3-fluorophenyl)-N-methylpyridine-2-carboxamide;5-chloro-3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]pyridine-2-carboxylic acid;3-fluoro-N-methylaniline;methane is sourced from PubChem (CID 159433012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).