[4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine

C86H78F10N28O4 — CID 158979134

About [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine

[4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine (PubChem CID 158979134) has the molecular formula C86H78F10N28O4 and a molecular weight of 1757.74 g/mol. Its IUPAC name is [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine.

Molecular Properties

• Compound Name: [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine
• PubChem CID: 158979134
• Molecular Formula: C86H78F10N28O4
• Molecular Weight: 1757.74 g/mol
• Exact Mass: 1756.66
• IUPAC Name: [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine
• SMILES: CC(O)c1cccc(-c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)c1.CC1COC(CO)CN1c1cc(-c2cnc3ccc(C(F)F)nn23)ncn1.Cc1cc(CO)cc(-c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)c1.FC(F)c1ccc2ncc(-c3cc(C4CCCNC4)ncn3)n2n1.FC(F)c1ccc2ncc(-c3cc(C4CCNC4)ncn3)n2n1
• InChI: InChI=1S/2C19H15F2N5O.C17H18F2N6O2.C16H16F2N6.C15H14F2N6/c1-11-4-12(9-27)6-13(5-11)15-7-16(24-10-23-15)17-8-22-18-3-2-14(19(20)21)25-26(17)18;1-11(27)12-3-2-4-13(7-12)15-8-16(24-10-23-15)17-9-22-18-6-5-14(19(20)21)25-26(17)18;1-10-8-27-11(7-26)6-24(10)16-4-13(21-9-22-16)14-5-20-15-3-2-12(17(18)19)23-25(14)15;17-16(18)11-3-4-15-20-8-14(24(15)23-11)13-6-12(21-9-22-13)10-2-1-5-19-7-10;16-15(17)10-1-2-14-19-7-13(23(14)22-10)12-5-11(20-8-21-12)9-3-4-18-6-9/h2-8,10,19,27H,9H2,1H3;2-11,19,27H,1H3;2-5,9-11,17,26H,6-8H2,1H3;3-4,6,8-10,16,19H,1-2,5,7H2;1-2,5,7-9,15,18H,3-4,6H2
• InChIKey: JOTQPCHWFDMHJZ-UHFFFAOYSA-N
• XLogP: 13.94
• TPSA: 377.07 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 32
• Rotatable Bonds: 18
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1757.74
LogP ≤ 5	13.94
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine?

The IUPAC name of [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine (CID 158979134) is [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine.

What is the SMILES notation for [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine?

The canonical SMILES for [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine is CC(O)c1cccc(-c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)c1.CC1COC(CO)CN1c1cc(-c2cnc3ccc(C(F)F)nn23)ncn1.Cc1cc(CO)cc(-c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)c1.FC(F)c1ccc2ncc(-c3cc(C4CCCNC4)ncn3)n2n1.FC(F)c1ccc2ncc(-c3cc(C4CCNC4)ncn3)n2n1.

What is the InChIKey of [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine?

The InChIKey is JOTQPCHWFDMHJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H15F2N5O.C17H18F2N6O2.C16H16F2N6.C15H14F2N6/c1-11-4-12(9-27)6-13(5-11)15-7-16(24-10-23-15)17-8-22-18-3-2-14(19(20)21)25-26(17)18;1-11(27)12-3-2-4-13(7-12)15-8-16(24-10-23-15)17-9-22-18-6-5-14(19(20)21)25-26(17)18;1-10-8-27-11(7-26)6-24(10)16-4-13(21-9-22-16)14-5-20-15-3-2-12(17(18)19)23-25(14)15;17-16(18)11-3-4-15-20-8-14(24(15)23-11)13-6-12(21-9-22-13)10-2-1-5-19-7-10;16-15(17)10-1-2-14-19-7-13(23(14)22-10)12-5-11(20-8-21-12)9-3-4-18-6-9/h2-8,10,19,27H,9H2,1H3;2-11,19,27H,1H3;2-5,9-11,17,26H,6-8H2,1H3;3-4,6,8-10,16,19H,1-2,5,7H2;1-2,5,7-9,15,18H,3-4,6H2.

What are the key properties of [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine?

[4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine has a molecular weight of 1757.74 g/mol, XLogP of 13.94, 18 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylmorpholin-2-yl]methanol;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5-methylphenyl]methanol;1-[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]phenyl]ethanol;6-(difluoromethyl)-3-(6-piperidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine;6-(difluoromethyl)-3-(6-pyrrolidin-3-ylpyrimidin-4-yl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 158979134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).