5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol

C67H79N21O6 — CID 165089286

About 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol

5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol (PubChem CID 165089286) has the molecular formula C67H79N21O6 and a molecular weight of 1274.51 g/mol. Its IUPAC name is 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol.

Molecular Properties

• Compound Name: 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol
• PubChem CID: 165089286
• Molecular Formula: C67H79N21O6
• Molecular Weight: 1274.51 g/mol
• Exact Mass: 1273.65
• IUPAC Name: 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol
• SMILES: CC1(C)CC(Oc2ccc(-c3ncc(-n4ccnn4)cc3O)nn2)CC(C)(C)N1.CC1(C)CC(Oc2ccc(-c3ncc(-n4cncn4)cc3O)nn2)CC(C)(C)N1.Cn1cc2cc(-c3cnc(-c4ccc(OC5CC(C)(C)NC(C)(C)C5)nn4)c(O)c3)cc(C#N)c2n1
• InChI: InChI=1S/C27H29N7O2.2C20H25N7O2/c1-26(2)11-20(12-27(3,4)33-26)36-23-7-6-21(30-31-23)25-22(35)10-18(14-29-25)16-8-17(13-28)24-19(9-16)15-34(5)32-24;1-19(2)8-14(9-20(3,4)26-19)29-17-6-5-15(24-25-17)18-16(28)7-13(10-22-18)27-12-21-11-23-27;1-19(2)10-14(11-20(3,4)25-19)29-17-6-5-15(23-24-17)18-16(28)9-13(12-21-18)27-8-7-22-26-27/h6-10,14-15,20,33,35H,11-12H2,1-5H3;5-7,10-12,14,26,28H,8-9H2,1-4H3;5-9,12,14,25,28H,10-11H2,1-4H3
• InChIKey: WKSYVJYTSAARDO-UHFFFAOYSA-N
• XLogP: 9.38
• TPSA: 343.51 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 27
• Rotatable Bonds: 12
• Heavy Atoms: 94
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1274.51
LogP ≤ 5	9.38
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol?

The IUPAC name of 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol (CID 165089286) is 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol.

What is the SMILES notation for 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol?

The canonical SMILES for 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol is CC1(C)CC(Oc2ccc(-c3ncc(-n4ccnn4)cc3O)nn2)CC(C)(C)N1.CC1(C)CC(Oc2ccc(-c3ncc(-n4cncn4)cc3O)nn2)CC(C)(C)N1.Cn1cc2cc(-c3cnc(-c4ccc(OC5CC(C)(C)NC(C)(C)C5)nn4)c(O)c3)cc(C#N)c2n1.

What is the InChIKey of 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol?

The InChIKey is WKSYVJYTSAARDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29N7O2.2C20H25N7O2/c1-26(2)11-20(12-27(3,4)33-26)36-23-7-6-21(30-31-23)25-22(35)10-18(14-29-25)16-8-17(13-28)24-19(9-16)15-34(5)32-24;1-19(2)8-14(9-20(3,4)26-19)29-17-6-5-15(24-25-17)18-16(28)7-13(10-22-18)27-12-21-11-23-27;1-19(2)10-14(11-20(3,4)25-19)29-17-6-5-15(23-24-17)18-16(28)9-13(12-21-18)27-8-7-22-26-27/h6-10,14-15,20,33,35H,11-12H2,1-5H3;5-7,10-12,14,26,28H,8-9H2,1-4H3;5-9,12,14,25,28H,10-11H2,1-4H3.

What are the key properties of 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol?

5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol has a molecular weight of 1274.51 g/mol, XLogP of 9.38, 12 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[5-hydroxy-6-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-3-pyridinyl]-2-methylindazole-7-carbonitrile;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(1,2,4-triazol-1-yl)pyridin-3-ol;2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]-5-(triazol-1-yl)pyridin-3-ol is sourced from PubChem (CID 165089286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).