5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol

C114H144N30O12 — CID 158500681

About 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol

5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol (PubChem CID 158500681) has the molecular formula C114H144N30O12 and a molecular weight of 2126.60 g/mol. Its IUPAC name is 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol.

Molecular Properties

• Compound Name: 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol
• PubChem CID: 158500681
• Molecular Formula: C114H144N30O12
• Molecular Weight: 2126.60 g/mol
• Exact Mass: 2125.16
• IUPAC Name: 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol
• SMILES: CC1(C)CC(Oc2ccc(-c3ccc(-n4cc(N)cn4)cc3O)nn2)CC(C)(C)N1.CC1(C)CC(Oc2ccc(-c3ccc(-n4ccnc4)cc3O)nn2)CC(C)(C)N1.CN(c1ccc(-c2ccc(-n3cc([N+](=O)[O-])cn3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.COc1cc(-n2cc([N+](=O)[O-])cn2)ccc1-c1ccc(N(C)C2CC(C)(C)NC(C)(C)C2)nn1.Cc1[nH]ncc1-c1ccc(-c2ccc(OC3CC(C)(C)NC(C)(C)C3)nn2)c(O)c1
• InChI: InChI=1S/C24H31N7O3.C23H29N7O3.C23H29N5O2.C22H28N6O2.C22H27N5O2/c1-23(2)12-17(13-24(3,4)28-23)29(5)22-10-9-20(26-27-22)19-8-7-16(11-21(19)34-6)30-15-18(14-25-30)31(32)33;1-22(2)11-16(12-23(3,4)27-22)28(5)21-9-8-19(25-26-21)18-7-6-15(10-20(18)31)29-14-17(13-24-29)30(32)33;1-14-18(13-24-25-14)15-6-7-17(20(29)10-15)19-8-9-21(27-26-19)30-16-11-22(2,3)28-23(4,5)12-16;1-21(2)10-16(11-22(3,4)27-21)30-20-8-7-18(25-26-20)17-6-5-15(9-19(17)29)28-13-14(23)12-24-28;1-21(2)12-16(13-22(3,4)26-21)29-20-8-7-18(24-25-20)17-6-5-15(11-19(17)28)27-10-9-23-14-27/h7-11,14-15,17,28H,12-13H2,1-6H3;6-10,13-14,16,27,31H,11-12H2,1-5H3;6-10,13,16,28-29H,11-12H2,1-5H3,(H,24,25);5-9,12-13,16,27,29H,10-11,23H2,1-4H3;5-11,14,16,26,28H,12-13H2,1-4H3
• InChIKey: HJVUWUYEOASBEI-UHFFFAOYSA-N
• XLogP: 18.94
• TPSA: 525.63 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 39
• Rotatable Bonds: 23
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2126.60
LogP ≤ 5	18.94
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol?

The IUPAC name of 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol (CID 158500681) is 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol.

What is the SMILES notation for 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol?

The canonical SMILES for 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol is CC1(C)CC(Oc2ccc(-c3ccc(-n4cc(N)cn4)cc3O)nn2)CC(C)(C)N1.CC1(C)CC(Oc2ccc(-c3ccc(-n4ccnc4)cc3O)nn2)CC(C)(C)N1.CN(c1ccc(-c2ccc(-n3cc([N+](=O)[O-])cn3)cc2O)nn1)C1CC(C)(C)NC(C)(C)C1.COc1cc(-n2cc([N+](=O)[O-])cn2)ccc1-c1ccc(N(C)C2CC(C)(C)NC(C)(C)C2)nn1.Cc1[nH]ncc1-c1ccc(-c2ccc(OC3CC(C)(C)NC(C)(C)C3)nn2)c(O)c1.

What is the InChIKey of 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol?

The InChIKey is HJVUWUYEOASBEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N7O3.C23H29N7O3.C23H29N5O2.C22H28N6O2.C22H27N5O2/c1-23(2)12-17(13-24(3,4)28-23)29(5)22-10-9-20(26-27-22)19-8-7-16(11-21(19)34-6)30-15-18(14-25-30)31(32)33;1-22(2)11-16(12-23(3,4)27-22)28(5)21-9-8-19(25-26-21)18-7-6-15(10-20(18)31)29-14-17(13-24-29)30(32)33;1-14-18(13-24-25-14)15-6-7-17(20(29)10-15)19-8-9-21(27-26-19)30-16-11-22(2,3)28-23(4,5)12-16;1-21(2)10-16(11-22(3,4)27-21)30-20-8-7-18(25-26-20)17-6-5-15(9-19(17)29)28-13-14(23)12-24-28;1-21(2)12-16(13-22(3,4)26-21)29-20-8-7-18(24-25-20)17-6-5-15(11-19(17)28)27-10-9-23-14-27/h7-11,14-15,17,28H,12-13H2,1-6H3;6-10,13-14,16,27,31H,11-12H2,1-5H3;6-10,13,16,28-29H,11-12H2,1-5H3,(H,24,25);5-9,12-13,16,27,29H,10-11,23H2,1-4H3;5-11,14,16,26,28H,12-13H2,1-4H3.

What are the key properties of 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol?

5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol has a molecular weight of 2126.60 g/mol, XLogP of 18.94, 23 rotatable bonds, 11 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(4-aminopyrazol-1-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-imidazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;6-[2-methoxy-4-(4-nitropyrazol-1-yl)phenyl]-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine;5-(5-methyl-1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;2-[6-[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]pyridazin-3-yl]-5-(4-nitropyrazol-1-yl)phenol is sourced from PubChem (CID 158500681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).