4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide

C122H107F9N20O22S4 — CID 158326059

IUPAC4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide
SMILESCNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C)ccc3F)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cccc(C)c3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3cc(C)ccc3F)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3ccc(C)c(C(F)(F)F)c3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3cccc(C)c3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3ccccc3)c(F)c2)ccn1
InChIInChI=1S/C21H17F4N3O4S.C21H19FN4O3.C21H20N4O3.C20H17F2N3O4S.C20H18FN3O4S.C19H16FN3O4S/c1-12-3-5-15(11-16(12)21(23,24)25)33(30,31)28-18-6-4-13(9-17(18)22)32-14-7-8-27-19(10-14)20(29)26-2;1-13-3-8-17(22)18(11-13)26-21(28)25-14-4-6-15(7-5-14)29-16-9-10-24-19(12-16)20(27)23-2;1-14-4-3-5-16(12-14)25-21(27)24-15-6-8-17(9-7-15)28-18-10-11-23-19(13-18)20(26)22-2;1-12-3-5-15(21)19(9-12)30(27,28)25-17-6-4-13(10-16(17)22)29-14-7-8-24-18(11-14)20(26)23-2;1-13-4-3-5-16(10-13)29(26,27)24-18-7-6-14(11-17(18)21)28-15-8-9-23-19(12-15)20(25)22-2;1-21-19(24)18-12-14(9-10-22-18)27-13-7-8-17(16(20)11-13)23-28(25,26)15-5-3-2-4-6-15/h3-11,28H,1-2H3,(H,26,29);3-12H,1-2H3,(H,23,27)(H2,25,26,28);3-13H,1-2H3,(H,22,26)(H2,24,25,27);3-11,25H,1-2H3,(H,23,26);3-12,24H,1-2H3,(H,22,25);2-12,23H,1H3,(H,21,24)
InChIKeyGPKOPATVPAEAKS-UHFFFAOYSA-N
MW2504.57 g/mol
LogP23.29
Rot. Bonds34

About 4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide

4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide (PubChem CID 158326059) has the molecular formula C122H107F9N20O22S4 and a molecular weight of 2504.57 g/mol. Its IUPAC name is 4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide
PubChem CID158326059
Molecular FormulaC122H107F9N20O22S4
Molecular Weight2504.57 g/mol
Exact Mass2502.66
IUPAC Name4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide
SMILESCNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C)ccc3F)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cccc(C)c3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3cc(C)ccc3F)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3ccc(C)c(C(F)(F)F)c3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3cccc(C)c3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3ccccc3)c(F)c2)ccn1
InChIInChI=1S/C21H17F4N3O4S.C21H19FN4O3.C21H20N4O3.C20H17F2N3O4S.C20H18FN3O4S.C19H16FN3O4S/c1-12-3-5-15(11-16(12)21(23,24)25)33(30,31)28-18-6-4-13(9-17(18)22)32-14-7-8-27-19(10-14)20(29)26-2;1-13-3-8-17(22)18(11-13)26-21(28)25-14-4-6-15(7-5-14)29-16-9-10-24-19(12-16)20(27)23-2;1-14-4-3-5-16(12-14)25-21(27)24-15-6-8-17(9-7-15)28-18-10-11-23-19(13-18)20(26)22-2;1-12-3-5-15(21)19(9-12)30(27,28)25-17-6-4-13(10-16(17)22)29-14-7-8-24-18(11-14)20(26)23-2;1-13-4-3-5-16(10-13)29(26,27)24-18-7-6-14(11-17(18)21)28-15-8-9-23-19(12-15)20(25)22-2;1-21-19(24)18-12-14(9-10-22-18)27-13-7-8-17(16(20)11-13)23-28(25,26)15-5-3-2-4-6-15/h3-11,28H,1-2H3,(H,26,29);3-12H,1-2H3,(H,23,27)(H2,25,26,28);3-13H,1-2H3,(H,22,26)(H2,24,25,27);3-11,25H,1-2H3,(H,23,26);3-12,24H,1-2H3,(H,22,25);2-12,23H,1H3,(H,21,24)
InChIKeyGPKOPATVPAEAKS-UHFFFAOYSA-N
XLogP23.29
TPSA574.26 Ų
H-Bond Donors14
H-Bond Acceptors28
Rotatable Bonds34
Heavy Atoms177
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002504.57
LogP ≤ 523.29
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1028

Analyze 4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide?
The IUPAC name of 4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide (CID 158326059) is 4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide.
What is the SMILES notation for 4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide?
The canonical SMILES for 4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide is CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C)ccc3F)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cccc(C)c3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3cc(C)ccc3F)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3ccc(C)c(C(F)(F)F)c3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3cccc(C)c3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NS(=O)(=O)c3ccccc3)c(F)c2)ccn1.
What is the InChIKey of 4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide?
The InChIKey is GPKOPATVPAEAKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17F4N3O4S.C21H19FN4O3.C21H20N4O3.C20H17F2N3O4S.C20H18FN3O4S.C19H16FN3O4S/c1-12-3-5-15(11-16(12)21(23,24)25)33(30,31)28-18-6-4-13(9-17(18)22)32-14-7-8-27-19(10-14)20(29)26-2;1-13-3-8-17(22)18(11-13)26-21(28)25-14-4-6-15(7-5-14)29-16-9-10-24-19(12-16)20(27)23-2;1-14-4-3-5-16(12-14)25-21(27)24-15-6-8-17(9-7-15)28-18-10-11-23-19(13-18)20(26)22-2;1-12-3-5-15(21)19(9-12)30(27,28)25-17-6-4-13(10-16(17)22)29-14-7-8-24-18(11-14)20(26)23-2;1-13-4-3-5-16(10-13)29(26,27)24-18-7-6-14(11-17(18)21)28-15-8-9-23-19(12-15)20(25)22-2;1-21-19(24)18-12-14(9-10-22-18)27-13-7-8-17(16(20)11-13)23-28(25,26)15-5-3-2-4-6-15/h3-11,28H,1-2H3,(H,26,29);3-12H,1-2H3,(H,23,27)(H2,25,26,28);3-13H,1-2H3,(H,22,26)(H2,24,25,27);3-11,25H,1-2H3,(H,23,26);3-12,24H,1-2H3,(H,22,25);2-12,23H,1H3,(H,21,24).
What are the key properties of 4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide?
4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide has a molecular weight of 2504.57 g/mol, XLogP of 23.29, 34 rotatable bonds, 14 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(benzenesulfonamido)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(2-fluoro-5-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[(3-methylphenyl)sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-[3-fluoro-4-[[4-methyl-3-(trifluoromethyl)phenyl]sulfonylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide is sourced from PubChem (CID 158326059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).