bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide

C128H113F11N24O18 — CID 159572184

About bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide

bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide (PubChem CID 159572184) has the molecular formula C128H113F11N24O18 and a molecular weight of 2484.44 g/mol. Its IUPAC name is bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide
• PubChem CID: 159572184
• Molecular Formula: C128H113F11N24O18
• Molecular Weight: 2484.44 g/mol
• Exact Mass: 2482.85
• IUPAC Name: bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide
• SMILES: CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3c(F)c(C)c(F)c(F)c3F)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C)ccc3F)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cccc(C(F)(F)C(C)(F)F)c3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cccc(C)c3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cccc(C)c3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cccc(C)c3)cc2)ccn1
• InChI: InChI=1S/C23H20F4N4O3.C21H16F4N4O3.3C21H19FN4O3.C21H20N4O3/c1-22(24,25)23(26,27)14-4-3-5-16(12-14)31-21(33)30-15-6-8-17(9-7-15)34-18-10-11-29-19(13-18)20(32)28-2;1-10-15(22)17(24)18(25)19(16(10)23)29-21(31)28-11-3-5-12(6-4-11)32-13-7-8-27-14(9-13)20(30)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;2*1-13-4-3-5-14(10-13)25-21(28)26-18-7-6-15(11-17(18)22)29-16-8-9-24-19(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/h3-13H,1-2H3,(H,28,32)(H2,30,31,33);3-9H,1-2H3,(H,26,30)(H2,28,29,31);3*3-12H,1-2H3,(H,23,27)(H2,25,26,28);3-13H,1-2H3,(H,22,26)(H2,24,25,27)
• InChIKey: MHYOHZVIADBADX-UHFFFAOYSA-N
• XLogP: 27.53
• TPSA: 554.10 Ų
• H-Bond Donors: 18
• H-Bond Acceptors: 24
• Rotatable Bonds: 32
• Heavy Atoms: 181
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2484.44
LogP ≤ 5	27.53
H-Bond Donors ≤ 5	18
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide?

The IUPAC name of bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide (CID 159572184) is bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide.

What is the SMILES notation for bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide?

The canonical SMILES for bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide is CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3c(F)c(C)c(F)c(F)c3F)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C)ccc3F)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cccc(C(F)(F)C(C)(F)F)c3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cccc(C)c3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cccc(C)c3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cccc(C)c3)cc2)ccn1.

What is the InChIKey of bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide?

The InChIKey is MHYOHZVIADBADX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20F4N4O3.C21H16F4N4O3.3C21H19FN4O3.C21H20N4O3/c1-22(24,25)23(26,27)14-4-3-5-16(12-14)31-21(33)30-15-6-8-17(9-7-15)34-18-10-11-29-19(13-18)20(32)28-2;1-10-15(22)17(24)18(25)19(16(10)23)29-21(31)28-11-3-5-12(6-4-11)32-13-7-8-27-14(9-13)20(30)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;2*1-13-4-3-5-14(10-13)25-21(28)26-18-7-6-15(11-17(18)22)29-16-8-9-24-19(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/h3-13H,1-2H3,(H,28,32)(H2,30,31,33);3-9H,1-2H3,(H,26,30)(H2,28,29,31);3*3-12H,1-2H3,(H,23,27)(H2,25,26,28);3-13H,1-2H3,(H,22,26)(H2,24,25,27).

What are the key properties of bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide?

bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide has a molecular weight of 2484.44 g/mol, XLogP of 27.53, 32 rotatable bonds, 18 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for bis(4-[3-fluoro-4-[(3-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[4-[(2-fluoro-5-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;N-methyl-4-[4-[(3-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[(2,3,4,6-tetrafluoro-5-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide;N-methyl-4-[4-[[3-(1,1,2,2-tetrafluoropropyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide is sourced from PubChem (CID 159572184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).