2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol

C139H159FN36O13 — CID 159529914

About 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol

2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol (PubChem CID 159529914) has the molecular formula C139H159FN36O13 and a molecular weight of 2561.04 g/mol. Its IUPAC name is 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol.

Molecular Properties

• Compound Name: 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol
• PubChem CID: 159529914
• Molecular Formula: C139H159FN36O13
• Molecular Weight: 2561.04 g/mol
• Exact Mass: 2559.29
• IUPAC Name: 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol
• SMILES: CC1(C)CC(Oc2ccc(-c3ccc(-c4cn[nH]c4)cc3O)nn2)CC(C)(C)N1.CC1(C)CC(Oc2ccc(-c3ccc(-n4cccn4)cc3O)nn2)CC(C)(C)N1.CC1CC(Oc2ccc(-c3ccc(-n4cccn4)cc3O)nn2)CCN1.CN1C(C)(C)CC(Oc2ccc(-c3ccc(-n4cccn4)cc3O)nn2)CC1(C)C.Oc1cc(-n2cccn2)ccc1-c1ccc(N2CCNCC2)nn1.Oc1cc(-n2cccn2)ccc1-c1ccc(OC2CCNCC2F)nn1.Oc1cc(-n2cccn2)ccc1-c1ccc(OCC2CCNC2)nn1
• InChI: InChI=1S/C23H29N5O2.2C22H27N5O2.C19H21N5O2.C18H18FN5O2.C18H19N5O2.C17H18N6O/c1-22(2)14-17(15-23(3,4)27(22)5)30-21-10-9-19(25-26-21)18-8-7-16(13-20(18)29)28-12-6-11-24-28;1-21(2)13-16(14-22(3,4)26-21)29-20-9-8-18(24-25-20)17-7-6-15(12-19(17)28)27-11-5-10-23-27;1-21(2)10-16(11-22(3,4)27-21)29-20-8-7-18(25-26-20)17-6-5-14(9-19(17)28)15-12-23-24-13-15;1-13-11-15(7-9-20-13)26-19-6-5-17(22-23-19)16-4-3-14(12-18(16)25)24-10-2-8-21-24;19-14-11-20-8-6-17(14)26-18-5-4-15(22-23-18)13-3-2-12(10-16(13)25)24-9-1-7-21-24;24-17-10-14(23-9-1-7-20-23)2-3-15(17)16-4-5-18(22-21-16)25-12-13-6-8-19-11-13;24-16-12-13(23-9-1-6-19-23)2-3-14(16)15-4-5-17(21-20-15)22-10-7-18-8-11-22/h6-13,17,29H,14-15H2,1-5H3;5-12,16,26,28H,13-14H2,1-4H3;5-9,12-13,16,27-28H,10-11H2,1-4H3,(H,23,24);2-6,8,10,12-13,15,20,25H,7,9,11H2,1H3;1-5,7,9-10,14,17,20,25H,6,8,11H2;1-5,7,9-10,13,19,24H,6,8,11-12H2;1-6,9,12,18,24H,7-8,10-11H2
• InChIKey: MCWAUCTYZASXBS-UHFFFAOYSA-N
• XLogP: 19.85
• TPSA: 591.71 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 48
• Rotatable Bonds: 28
• Heavy Atoms: 189
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2561.04
LogP ≤ 5	19.85
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	48

Frequently Asked Questions

What is the IUPAC name of 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol?

The IUPAC name of 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol (CID 159529914) is 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol.

What is the SMILES notation for 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol?

The canonical SMILES for 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol is CC1(C)CC(Oc2ccc(-c3ccc(-c4cn[nH]c4)cc3O)nn2)CC(C)(C)N1.CC1(C)CC(Oc2ccc(-c3ccc(-n4cccn4)cc3O)nn2)CC(C)(C)N1.CC1CC(Oc2ccc(-c3ccc(-n4cccn4)cc3O)nn2)CCN1.CN1C(C)(C)CC(Oc2ccc(-c3ccc(-n4cccn4)cc3O)nn2)CC1(C)C.Oc1cc(-n2cccn2)ccc1-c1ccc(N2CCNCC2)nn1.Oc1cc(-n2cccn2)ccc1-c1ccc(OC2CCNCC2F)nn1.Oc1cc(-n2cccn2)ccc1-c1ccc(OCC2CCNC2)nn1.

What is the InChIKey of 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol?

The InChIKey is MCWAUCTYZASXBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N5O2.2C22H27N5O2.C19H21N5O2.C18H18FN5O2.C18H19N5O2.C17H18N6O/c1-22(2)14-17(15-23(3,4)27(22)5)30-21-10-9-19(25-26-21)18-8-7-16(13-20(18)29)28-12-6-11-24-28;1-21(2)13-16(14-22(3,4)26-21)29-20-9-8-18(24-25-20)17-7-6-15(12-19(17)28)27-11-5-10-23-27;1-21(2)10-16(11-22(3,4)27-21)29-20-8-7-18(25-26-20)17-6-5-14(9-19(17)28)15-12-23-24-13-15;1-13-11-15(7-9-20-13)26-19-6-5-17(22-23-19)16-4-3-14(12-18(16)25)24-10-2-8-21-24;19-14-11-20-8-6-17(14)26-18-5-4-15(22-23-18)13-3-2-12(10-16(13)25)24-9-1-7-21-24;24-17-10-14(23-9-1-7-20-23)2-3-15(17)16-4-5-18(22-21-16)25-12-13-6-8-19-11-13;24-16-12-13(23-9-1-6-19-23)2-3-14(16)15-4-5-17(21-20-15)22-10-7-18-8-11-22/h6-13,17,29H,14-15H2,1-5H3;5-12,16,26,28H,13-14H2,1-4H3;5-9,12-13,16,27-28H,10-11H2,1-4H3,(H,23,24);2-6,8,10,12-13,15,20,25H,7,9,11H2,1H3;1-5,7,9-10,14,17,20,25H,6,8,11H2;1-5,7,9-10,13,19,24H,6,8,11-12H2;1-6,9,12,18,24H,7-8,10-11H2.

What are the key properties of 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol?

2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol has a molecular weight of 2561.04 g/mol, XLogP of 19.85, 28 rotatable bonds, 14 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[6-(3-fluoropiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(2-methylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-[6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypyridazin-3-yl]-5-pyrazol-1-ylphenol;2-(6-piperazin-1-ylpyridazin-3-yl)-5-pyrazol-1-ylphenol;5-pyrazol-1-yl-2-[6-(pyrrolidin-3-ylmethoxy)pyridazin-3-yl]phenol;5-pyrazol-1-yl-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol;5-(1H-pyrazol-4-yl)-2-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenol is sourced from PubChem (CID 159529914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).