5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol

C131H165ClF2N42O7 — CID 158324318

About 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol

5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol (PubChem CID 158324318) has the molecular formula C131H165ClF2N42O7 and a molecular weight of 2513.50 g/mol. Its IUPAC name is 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol.

Molecular Properties

• Compound Name: 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol
• PubChem CID: 158324318
• Molecular Formula: C131H165ClF2N42O7
• Molecular Weight: 2513.50 g/mol
• Exact Mass: 2511.35
• IUPAC Name: 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol
• SMILES: CC1(C)CC(Oc2ncc(-c3ccc(-n4nccn4)cc3O)nn2)CC(C)(C)N1.CCN(CC)C1C2CN(c3ncc(-c4ccc(-c5cn[nH]c5)cc4O)nn3)CC21.CN(c1ncc(-c2cc(F)c(-c3ccn[nH]3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ncc(-c2ccc(-c3ccc(Cl)nn3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ncc(-c2ccc(-c3ccn(C)n3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ncc(-c2ccc(-c3cn[nH]c3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1F
• InChI: InChI=1S/C23H28ClN7O.C23H31N7O.2C22H28FN7O.C21H25N7O.C20H25N7O2/c1-22(2)11-15(12-23(3,4)30-22)31(5)21-25-13-18(27-29-21)16-7-6-14(10-19(16)32)17-8-9-20(24)28-26-17;1-22(2)12-16(13-23(3,4)28-22)30(6)21-24-14-19(25-26-21)17-8-7-15(11-20(17)31)18-9-10-29(5)27-18;1-21(2)10-13(11-22(3,4)29-21)30(5)20-24-12-18(27-28-20)15-8-16(23)14(9-19(15)31)17-6-7-25-26-17;1-21(2)9-17(19(23)22(3,4)29-21)30(5)20-24-12-16(27-28-20)15-7-6-13(8-18(15)31)14-10-25-26-11-14;1-3-27(4-2)20-16-11-28(12-17(16)20)21-22-10-18(25-26-21)15-6-5-13(7-19(15)29)14-8-23-24-9-14;1-19(2)10-14(11-20(3,4)26-19)29-18-21-12-16(24-25-18)15-6-5-13(9-17(15)28)27-22-7-8-23-27/h6-10,13,15,30,32H,11-12H2,1-5H3;7-11,14,16,28,31H,12-13H2,1-6H3;6-9,12-13,29,31H,10-11H2,1-5H3,(H,25,26);6-8,10-12,17,19,29,31H,9H2,1-5H3,(H,25,26);5-10,16-17,20,29H,3-4,11-12H2,1-2H3,(H,23,24);5-9,12,14,26,28H,10-11H2,1-4H3
• InChIKey: GPFNFLHZTKGILG-UHFFFAOYSA-N
• XLogP: 19.26
• TPSA: 602.57 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 46
• Rotatable Bonds: 26
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2513.50
LogP ≤ 5	19.26
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	46

Frequently Asked Questions

What is the IUPAC name of 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol?

The IUPAC name of 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol (CID 158324318) is 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol.

What is the SMILES notation for 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol?

The canonical SMILES for 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol is CC1(C)CC(Oc2ncc(-c3ccc(-n4nccn4)cc3O)nn2)CC(C)(C)N1.CCN(CC)C1C2CN(c3ncc(-c4ccc(-c5cn[nH]c5)cc4O)nn3)CC21.CN(c1ncc(-c2cc(F)c(-c3ccn[nH]3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ncc(-c2ccc(-c3ccc(Cl)nn3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ncc(-c2ccc(-c3ccn(C)n3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.CN(c1ncc(-c2ccc(-c3cn[nH]c3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1F.

What is the InChIKey of 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol?

The InChIKey is GPFNFLHZTKGILG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28ClN7O.C23H31N7O.2C22H28FN7O.C21H25N7O.C20H25N7O2/c1-22(2)11-15(12-23(3,4)30-22)31(5)21-25-13-18(27-29-21)16-7-6-14(10-19(16)32)17-8-9-20(24)28-26-17;1-22(2)12-16(13-23(3,4)28-22)30(6)21-24-14-19(25-26-21)17-8-7-15(11-20(17)31)18-9-10-29(5)27-18;1-21(2)10-13(11-22(3,4)29-21)30(5)20-24-12-18(27-28-20)15-8-16(23)14(9-19(15)31)17-6-7-25-26-17;1-21(2)9-17(19(23)22(3,4)29-21)30(5)20-24-12-16(27-28-20)15-7-6-13(8-18(15)31)14-10-25-26-11-14;1-3-27(4-2)20-16-11-28(12-17(16)20)21-22-10-18(25-26-21)15-6-5-13(7-19(15)29)14-8-23-24-9-14;1-19(2)10-14(11-20(3,4)26-19)29-18-21-12-16(24-25-18)15-6-5-13(9-17(15)28)27-22-7-8-23-27/h6-10,13,15,30,32H,11-12H2,1-5H3;7-11,14,16,28,31H,12-13H2,1-6H3;6-9,12-13,29,31H,10-11H2,1-5H3,(H,25,26);6-8,10-12,17,19,29,31H,9H2,1-5H3,(H,25,26);5-10,16-17,20,29H,3-4,11-12H2,1-2H3,(H,23,24);5-9,12,14,26,28H,10-11H2,1-4H3.

What are the key properties of 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol?

5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol has a molecular weight of 2513.50 g/mol, XLogP of 19.26, 26 rotatable bonds, 14 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(6-chloropyridazin-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[6-(diethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;4-fluoro-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-5-yl)phenol;2-[3-[(3-fluoro-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,2,4-triazin-6-yl]-5-(1H-pyrazol-4-yl)phenol;5-(1-methylpyrazol-3-yl)-2-[3-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,2,4-triazin-6-yl]-5-(triazol-2-yl)phenol is sourced from PubChem (CID 158324318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).