5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol

C125H151F2N43O6S — CID 161435605

About 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol

5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol (PubChem CID 161435605) has the molecular formula C125H151F2N43O6S and a molecular weight of 2421.94 g/mol. Its IUPAC name is 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol.

Molecular Properties

• Compound Name: 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol
• PubChem CID: 161435605
• Molecular Formula: C125H151F2N43O6S
• Molecular Weight: 2421.94 g/mol
• Exact Mass: 2420.25
• IUPAC Name: 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol
• SMILES: CC1(C)CC(Nc2ncc(-c3ccc(-n4cc(F)cn4)cc3O)nn2)CC(C)(C)N1.CC1(C)CC(Nc2ncc(-c3ccc(-n4ccnc4)cc3O)nn2)CC(C)(C)N1.CC1(C)CC(Nc2ncc(-c3ccc(-n4cnc(F)c4)cc3O)nn2)CC(C)(C)N1.CN1CCC2(CC1)CN(c1ncc(-c3ccc(-c4ncns4)cc3O)nn1)C2.CNC1CCN(c2ncc(-c3ccc(-c4cc5cnn(C)c5cn4)cc3O)nn2)C1.Cc1cn(-c2ccc(-c3cnc(NC4CC(C)(C)NC(C)(C)C4)nn3)c(O)c2)cn1
• InChI: InChI=1S/C22H29N7O.2C21H26FN7O.C21H22N8O.C21H27N7O.C19H21N7OS/c1-14-12-29(13-24-14)16-6-7-17(19(30)8-16)18-11-23-20(27-26-18)25-15-9-21(2,3)28-22(4,5)10-15;1-20(2)8-14(9-21(3,4)28-20)25-19-23-11-17(26-27-19)16-6-5-15(7-18(16)30)29-12-13(22)10-24-29;1-20(2)8-13(9-21(3,4)28-20)25-19-23-10-16(26-27-19)15-6-5-14(7-17(15)30)29-11-18(22)24-12-29;1-22-15-5-6-29(12-15)21-24-10-18(26-27-21)16-4-3-13(8-20(16)30)17-7-14-9-25-28(2)19(14)11-23-17;1-20(2)10-14(11-21(3,4)27-20)24-19-23-12-17(25-26-19)16-6-5-15(9-18(16)29)28-8-7-22-13-28;1-25-6-4-19(5-7-25)10-26(11-19)18-20-9-15(23-24-18)14-3-2-13(8-16(14)27)17-21-12-22-28-17/h6-8,11-13,15,28,30H,9-10H2,1-5H3,(H,23,25,27);5-7,10-12,14,28,30H,8-9H2,1-4H3,(H,23,25,27);5-7,10-13,28,30H,8-9H2,1-4H3,(H,23,25,27);3-4,7-11,15,22,30H,5-6,12H2,1-2H3;5-9,12-14,27,29H,10-11H2,1-4H3,(H,23,24,26);2-3,8-9,12,27H,4-7,10-11H2,1H3
• InChIKey: VYPIGTUHLQNPQQ-UHFFFAOYSA-N
• XLogP: 17.48
• TPSA: 599.16 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 50
• Rotatable Bonds: 23
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2421.94
LogP ≤ 5	17.48
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	50

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol?

The IUPAC name of 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol (CID 161435605) is 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol.

What is the SMILES notation for 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol?

The canonical SMILES for 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol is CC1(C)CC(Nc2ncc(-c3ccc(-n4cc(F)cn4)cc3O)nn2)CC(C)(C)N1.CC1(C)CC(Nc2ncc(-c3ccc(-n4ccnc4)cc3O)nn2)CC(C)(C)N1.CC1(C)CC(Nc2ncc(-c3ccc(-n4cnc(F)c4)cc3O)nn2)CC(C)(C)N1.CN1CCC2(CC1)CN(c1ncc(-c3ccc(-c4ncns4)cc3O)nn1)C2.CNC1CCN(c2ncc(-c3ccc(-c4cc5cnn(C)c5cn4)cc3O)nn2)C1.Cc1cn(-c2ccc(-c3cnc(NC4CC(C)(C)NC(C)(C)C4)nn3)c(O)c2)cn1.

What is the InChIKey of 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol?

The InChIKey is VYPIGTUHLQNPQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N7O.2C21H26FN7O.C21H22N8O.C21H27N7O.C19H21N7OS/c1-14-12-29(13-24-14)16-6-7-17(19(30)8-16)18-11-23-20(27-26-18)25-15-9-21(2,3)28-22(4,5)10-15;1-20(2)8-14(9-21(3,4)28-20)25-19-23-11-17(26-27-19)16-6-5-15(7-18(16)30)29-12-13(22)10-24-29;1-20(2)8-13(9-21(3,4)28-20)25-19-23-10-16(26-27-19)15-6-5-14(7-17(15)30)29-11-18(22)24-12-29;1-22-15-5-6-29(12-15)21-24-10-18(26-27-21)16-4-3-13(8-20(16)30)17-7-14-9-25-28(2)19(14)11-23-17;1-20(2)10-14(11-21(3,4)27-20)24-19-23-12-17(25-26-19)16-6-5-15(9-18(16)29)28-8-7-22-13-28;1-25-6-4-19(5-7-25)10-26(11-19)18-20-9-15(23-24-18)14-3-2-13(8-16(14)27)17-21-12-22-28-17/h6-8,11-13,15,28,30H,9-10H2,1-5H3,(H,23,25,27);5-7,10-12,14,28,30H,8-9H2,1-4H3,(H,23,25,27);5-7,10-13,28,30H,8-9H2,1-4H3,(H,23,25,27);3-4,7-11,15,22,30H,5-6,12H2,1-2H3;5-9,12-14,27,29H,10-11H2,1-4H3,(H,23,24,26);2-3,8-9,12,27H,4-7,10-11H2,1H3.

What are the key properties of 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol?

5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol has a molecular weight of 2421.94 g/mol, XLogP of 17.48, 23 rotatable bonds, 15 hydrogen bond donors, and 50 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(4-fluoroimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-(4-fluoropyrazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;5-imidazol-1-yl-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol;2-[3-[3-(methylamino)pyrrolidin-1-yl]-1,2,4-triazin-6-yl]-5-(1-methylpyrazolo[3,4-c]pyridin-5-yl)phenol;2-[3-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)-1,2,4-triazin-6-yl]-5-(1,2,4-thiadiazol-5-yl)phenol;5-(4-methylimidazol-1-yl)-2-[3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,2,4-triazin-6-yl]phenol is sourced from PubChem (CID 161435605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).