4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine

C136H140F21N51O2 — CID 158948087

IUPAC4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine
SMILESCCN(CC(C)(C)C)c1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2cccc(C)n2)n1.Cc1cccc(-c2nc(NOC(C)(C)C)nc(Nc3ccnc(C(F)(F)F)c3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(N3CC(C)(C)C3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(N3CC(C)(O)C3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(N3CC(C)C3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(NN(C)C)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(NN3CCCCC3)n2)n1
InChIInChI=1S/C22H26F3N7.C20H21F3N8.C20H20F3N7.C19H18F3N7O.C19H20F3N7O.C19H18F3N7.C17H17F3N8/c1-6-32(13-21(3,4)5)20-30-18(16-9-7-8-14(2)27-16)29-19(31-20)28-15-10-11-26-17(12-15)22(23,24)25;1-13-6-5-7-15(25-13)17-27-18(26-14-8-9-24-16(12-14)20(21,22)23)29-19(28-17)30-31-10-3-2-4-11-31;1-12-5-4-6-14(25-12)16-27-17(29-18(28-16)30-10-19(2,3)11-30)26-13-7-8-24-15(9-13)20(21,22)23;1-11-4-3-5-13(24-11)15-26-16(28-17(27-15)29-9-18(2,30)10-29)25-12-6-7-23-14(8-12)19(20,21)22;1-11-6-5-7-13(24-11)15-26-16(28-17(27-15)29-30-18(2,3)4)25-12-8-9-23-14(10-12)19(20,21)22;1-11-9-29(10-11)18-27-16(14-5-3-4-12(2)24-14)26-17(28-18)25-13-6-7-23-15(8-13)19(20,21)22;1-10-5-4-6-12(22-10)14-24-15(26-16(25-14)27-28(2)3)23-11-7-8-21-13(9-11)17(18,19)20/h7-12H,6,13H2,1-5H3,(H,26,28,29,30,31);5-9,12H,2-4,10-11H2,1H3,(H2,24,26,27,28,29,30);4-9H,10-11H2,1-3H3,(H,24,26,27,28,29);3-8,30H,9-10H2,1-2H3,(H,23,25,26,27,28);5-10H,1-4H3,(H2,23,25,26,27,28,29);3-8,11H,9-10H2,1-2H3,(H,23,25,26,27,28);4-9H,1-3H3,(H2,21,23,24,25,26,27)
InChIKeyJLBQMUIQKYVFIR-UHFFFAOYSA-N
MW2919.93 g/mol
LogP28.38
Rot. Bonds33

About 4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine

4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine (PubChem CID 158948087) has the molecular formula C136H140F21N51O2 and a molecular weight of 2919.93 g/mol. Its IUPAC name is 4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine
PubChem CID158948087
Molecular FormulaC136H140F21N51O2
Molecular Weight2919.93 g/mol
Exact Mass2918.21
IUPAC Name4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine
SMILESCCN(CC(C)(C)C)c1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2cccc(C)n2)n1.Cc1cccc(-c2nc(NOC(C)(C)C)nc(Nc3ccnc(C(F)(F)F)c3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(N3CC(C)(C)C3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(N3CC(C)(O)C3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(N3CC(C)C3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(NN(C)C)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(NN3CCCCC3)n2)n1
InChIInChI=1S/C22H26F3N7.C20H21F3N8.C20H20F3N7.C19H18F3N7O.C19H20F3N7O.C19H18F3N7.C17H17F3N8/c1-6-32(13-21(3,4)5)20-30-18(16-9-7-8-14(2)27-16)29-19(31-20)28-15-10-11-26-17(12-15)22(23,24)25;1-13-6-5-7-15(25-13)17-27-18(26-14-8-9-24-16(12-14)20(21,22)23)29-19(28-17)30-31-10-3-2-4-11-31;1-12-5-4-6-14(25-12)16-27-17(29-18(28-16)30-10-19(2,3)11-30)26-13-7-8-24-15(9-13)20(21,22)23;1-11-4-3-5-13(24-11)15-26-16(28-17(27-15)29-9-18(2,30)10-29)25-12-6-7-23-14(8-12)19(20,21)22;1-11-6-5-7-13(24-11)15-26-16(28-17(27-15)29-30-18(2,3)4)25-12-8-9-23-14(10-12)19(20,21)22;1-11-9-29(10-11)18-27-16(14-5-3-4-12(2)24-14)26-17(28-18)25-13-6-7-23-15(8-13)19(20,21)22;1-10-5-4-6-12(22-10)14-24-15(26-16(25-14)27-28(2)3)23-11-7-8-21-13(9-11)17(18,19)20/h7-12H,6,13H2,1-5H3,(H,26,28,29,30,31);5-9,12H,2-4,10-11H2,1H3,(H2,24,26,27,28,29,30);4-9H,10-11H2,1-3H3,(H,24,26,27,28,29);3-8,30H,9-10H2,1-2H3,(H,23,25,26,27,28);5-10H,1-4H3,(H2,23,25,26,27,28,29);3-8,11H,9-10H2,1-2H3,(H,23,25,26,27,28);4-9H,1-3H3,(H2,21,23,24,25,26,27)
InChIKeyJLBQMUIQKYVFIR-UHFFFAOYSA-N
XLogP28.38
TPSA620.35 Ų
H-Bond Donors11
H-Bond Acceptors53
Rotatable Bonds33
Heavy Atoms210
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002919.93
LogP ≤ 528.38
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1053

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine?
The IUPAC name of 4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine (CID 158948087) is 4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine is CCN(CC(C)(C)C)c1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2cccc(C)n2)n1.Cc1cccc(-c2nc(NOC(C)(C)C)nc(Nc3ccnc(C(F)(F)F)c3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(N3CC(C)(C)C3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(N3CC(C)(O)C3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(N3CC(C)C3)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(NN(C)C)n2)n1.Cc1cccc(-c2nc(Nc3ccnc(C(F)(F)F)c3)nc(NN3CCCCC3)n2)n1.
What is the InChIKey of 4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine?
The InChIKey is JLBQMUIQKYVFIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26F3N7.C20H21F3N8.C20H20F3N7.C19H18F3N7O.C19H20F3N7O.C19H18F3N7.C17H17F3N8/c1-6-32(13-21(3,4)5)20-30-18(16-9-7-8-14(2)27-16)29-19(31-20)28-15-10-11-26-17(12-15)22(23,24)25;1-13-6-5-7-15(25-13)17-27-18(26-14-8-9-24-16(12-14)20(21,22)23)29-19(28-17)30-31-10-3-2-4-11-31;1-12-5-4-6-14(25-12)16-27-17(29-18(28-16)30-10-19(2,3)11-30)26-13-7-8-24-15(9-13)20(21,22)23;1-11-4-3-5-13(24-11)15-26-16(28-17(27-15)29-9-18(2,30)10-29)25-12-6-7-23-14(8-12)19(20,21)22;1-11-6-5-7-13(24-11)15-26-16(28-17(27-15)29-30-18(2,3)4)25-12-8-9-23-14(10-12)19(20,21)22;1-11-9-29(10-11)18-27-16(14-5-3-4-12(2)24-14)26-17(28-18)25-13-6-7-23-15(8-13)19(20,21)22;1-10-5-4-6-12(22-10)14-24-15(26-16(25-14)27-28(2)3)23-11-7-8-21-13(9-11)17(18,19)20/h7-12H,6,13H2,1-5H3,(H,26,28,29,30,31);5-9,12H,2-4,10-11H2,1H3,(H2,24,26,27,28,29,30);4-9H,10-11H2,1-3H3,(H,24,26,27,28,29);3-8,30H,9-10H2,1-2H3,(H,23,25,26,27,28);5-10H,1-4H3,(H2,23,25,26,27,28,29);3-8,11H,9-10H2,1-2H3,(H,23,25,26,27,28);4-9H,1-3H3,(H2,21,23,24,25,26,27).
What are the key properties of 4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine?
4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine has a molecular weight of 2919.93 g/mol, XLogP of 28.38, 33 rotatable bonds, 11 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,3-dimethylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;4-(2,2-dimethylhydrazinyl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;2-N-(2,2-dimethylpropyl)-2-N-ethyl-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;4-(3-methylazetidin-1-yl)-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine;3-methyl-1-[4-(6-methyl-2-pyridinyl)-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]azetidin-3-ol;2-N-[(2-methylpropan-2-yl)oxy]-6-(6-methyl-2-pyridinyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine;6-(6-methyl-2-pyridinyl)-2-N-piperidin-1-yl-4-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 158948087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).