5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide

C120H103F20N25O6 — CID 161431727

About 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide

5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide (PubChem CID 161431727) has the molecular formula C120H103F20N25O6 and a molecular weight of 2371.27 g/mol. Its IUPAC name is 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide.

Molecular Properties

• Compound Name: 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide
• PubChem CID: 161431727
• Molecular Formula: C120H103F20N25O6
• Molecular Weight: 2371.27 g/mol
• Exact Mass: 2369.82
• IUPAC Name: 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide
• SMILES: C=C1CCCN1c1ccc(Nc2cc(Nc3ccc(F)cc3C(=O)NC)c(C(F)(F)F)cn2)cc1.C=C1CCc2cc(Nc3cc(Nc4ccc(F)cc4C(=O)NC)c(C(F)(F)F)cn3)ccc2C1.C=C1Cc2ccc(Nc3cc(Nc4ccc(F)cc4C(=O)NC)c(C(F)(F)F)cn3)cc2N1.CNC(=O)c1cc(F)ccc1Nc1cc(Nc2cc(-c3cccnc3)nc(C)n2)ncc1C(F)(F)F.CNC(=O)c1cc(F)ccc1Nc1cc(Nc2ccc(CC(C)=O)cc2)ncc1C(F)(F)F
• InChI: InChI=1S/C25H23F4N5O.C25H22F4N4O.C24H19F4N7O.C23H19F4N5O.C23H20F4N4O2/c1-15-4-3-11-34(15)18-8-6-17(7-9-18)32-23-13-22(20(14-31-23)25(27,28)29)33-21-10-5-16(26)12-19(21)24(35)30-2;1-14-3-4-16-10-18(7-5-15(16)9-14)32-23-12-22(20(13-31-23)25(27,28)29)33-21-8-6-17(26)11-19(21)24(34)30-2;1-13-32-19(14-4-3-7-30-11-14)9-22(33-13)35-21-10-20(17(12-31-21)24(26,27)28)34-18-6-5-15(25)8-16(18)23(36)29-2;1-12-7-13-3-5-15(9-19(13)30-12)31-21-10-20(17(11-29-21)23(25,26)27)32-18-6-4-14(24)8-16(18)22(33)28-2;1-13(32)9-14-3-6-16(7-4-14)30-21-11-20(18(12-29-21)23(25,26)27)31-19-8-5-15(24)10-17(19)22(33)28-2/h5-10,12-14H,1,3-4,11H2,2H3,(H,30,35)(H2,31,32,33);5-8,10-13H,1,3-4,9H2,2H3,(H,30,34)(H2,31,32,33);3-12H,1-2H3,(H,29,36)(H2,31,32,33,34,35);3-6,8-11,30H,1,7H2,2H3,(H,28,33)(H2,29,31,32);3-8,10-12H,9H2,1-2H3,(H,28,33)(H2,29,30,31)
• InChIKey: VYCHELQPUMAJDZ-UHFFFAOYSA-N
• XLogP: 28.36
• TPSA: 401.26 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 26
• Rotatable Bonds: 29
• Heavy Atoms: 171
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2371.27
LogP ≤ 5	28.36
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide?

The IUPAC name of 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide (CID 161431727) is 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide.

What is the SMILES notation for 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide?

The canonical SMILES for 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide is C=C1CCCN1c1ccc(Nc2cc(Nc3ccc(F)cc3C(=O)NC)c(C(F)(F)F)cn2)cc1.C=C1CCc2cc(Nc3cc(Nc4ccc(F)cc4C(=O)NC)c(C(F)(F)F)cn3)ccc2C1.C=C1Cc2ccc(Nc3cc(Nc4ccc(F)cc4C(=O)NC)c(C(F)(F)F)cn3)cc2N1.CNC(=O)c1cc(F)ccc1Nc1cc(Nc2cc(-c3cccnc3)nc(C)n2)ncc1C(F)(F)F.CNC(=O)c1cc(F)ccc1Nc1cc(Nc2ccc(CC(C)=O)cc2)ncc1C(F)(F)F.

What is the InChIKey of 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide?

The InChIKey is VYCHELQPUMAJDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23F4N5O.C25H22F4N4O.C24H19F4N7O.C23H19F4N5O.C23H20F4N4O2/c1-15-4-3-11-34(15)18-8-6-17(7-9-18)32-23-13-22(20(14-31-23)25(27,28)29)33-21-10-5-16(26)12-19(21)24(35)30-2;1-14-3-4-16-10-18(7-5-15(16)9-14)32-23-12-22(20(13-31-23)25(27,28)29)33-21-8-6-17(26)11-19(21)24(34)30-2;1-13-32-19(14-4-3-7-30-11-14)9-22(33-13)35-21-10-20(17(12-31-21)24(26,27)28)34-18-6-5-15(25)8-16(18)23(36)29-2;1-12-7-13-3-5-15(9-19(13)30-12)31-21-10-20(17(11-29-21)23(25,26)27)32-18-6-4-14(24)8-16(18)22(33)28-2;1-13(32)9-14-3-6-16(7-4-14)30-21-11-20(18(12-29-21)23(25,26)27)31-19-8-5-15(24)10-17(19)22(33)28-2/h5-10,12-14H,1,3-4,11H2,2H3,(H,30,35)(H2,31,32,33);5-8,10-13H,1,3-4,9H2,2H3,(H,30,34)(H2,31,32,33);3-12H,1-2H3,(H,29,36)(H2,31,32,33,34,35);3-6,8-11,30H,1,7H2,2H3,(H,28,33)(H2,29,31,32);3-8,10-12H,9H2,1-2H3,(H,28,33)(H2,29,30,31).

What are the key properties of 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide?

5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide has a molecular weight of 2371.27 g/mol, XLogP of 28.36, 29 rotatable bonds, 16 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 5-fluoro-N-methyl-2-[[2-[(2-methylidene-1,3-dihydroindol-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(6-methylidene-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-methylidenepyrrolidin-1-yl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;5-fluoro-N-methyl-2-[[2-[4-(2-oxopropyl)anilino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide is sourced from PubChem (CID 161431727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).