4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine

C114H105Cl3F6N18O6 — CID 160677122

About 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine

4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine (PubChem CID 160677122) has the molecular formula C114H105Cl3F6N18O6 and a molecular weight of 2043.56 g/mol. Its IUPAC name is 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine.

Molecular Properties

• Compound Name: 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
• PubChem CID: 160677122
• Molecular Formula: C114H105Cl3F6N18O6
• Molecular Weight: 2043.56 g/mol
• Exact Mass: 2040.74
• IUPAC Name: 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
• SMILES: Clc1ccc(-c2nc3ccc(-c4ccccc4)nn3c2CN2CCOCC2)cc1.Clc1ccc(-c2nc3ccc(-c4cncnc4)cn3c2CN2CCOCC2)cc1.FC(F)(F)c1ccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCOCC2)cc1.FC(F)(F)c1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1.OCc1nc2ccc(-c3ccccc3)cn2c1CN1CCOCC1
• InChI: InChI=1S/C25H21ClF3N3O.C25H22F3N3O.C23H21ClN4O.C22H20ClN5O.C19H21N3O2/c26-19-8-5-17(6-9-19)24-22(16-31-11-13-33-14-12-31)32-15-18(7-10-23(32)30-24)20-3-1-2-4-21(20)25(27,28)29;26-25(27,28)21-9-6-19(7-10-21)24-22(17-30-12-14-32-15-13-30)31-16-20(8-11-23(31)29-24)18-4-2-1-3-5-18;24-19-8-6-18(7-9-19)23-21(16-27-12-14-29-15-13-27)28-22(25-23)11-10-20(26-28)17-4-2-1-3-5-17;23-19-4-1-16(2-5-19)22-20(14-27-7-9-29-10-8-27)28-13-17(3-6-21(28)26-22)18-11-24-15-25-12-18;23-14-17-18(13-21-8-10-24-11-9-21)22-12-16(6-7-19(22)20-17)15-4-2-1-3-5-15/h1-10,15H,11-14,16H2;1-11,16H,12-15,17H2;1-11H,12-16H2;1-6,11-13,15H,7-10,14H2;1-7,12,23H,8-11,13-14H2
• InChIKey: RNRCYWBBXMWMAY-UHFFFAOYSA-N
• XLogP: 22.51
• TPSA: 207.75 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 24
• Rotatable Bonds: 20
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2043.56
LogP ≤ 5	22.51
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?

The IUPAC name of 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine (CID 160677122) is 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine.

What is the SMILES notation for 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?

The canonical SMILES for 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine is Clc1ccc(-c2nc3ccc(-c4ccccc4)nn3c2CN2CCOCC2)cc1.Clc1ccc(-c2nc3ccc(-c4cncnc4)cn3c2CN2CCOCC2)cc1.FC(F)(F)c1ccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCOCC2)cc1.FC(F)(F)c1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1.OCc1nc2ccc(-c3ccccc3)cn2c1CN1CCOCC1.

What is the InChIKey of 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?

The InChIKey is RNRCYWBBXMWMAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21ClF3N3O.C25H22F3N3O.C23H21ClN4O.C22H20ClN5O.C19H21N3O2/c26-19-8-5-17(6-9-19)24-22(16-31-11-13-33-14-12-31)32-15-18(7-10-23(32)30-24)20-3-1-2-4-21(20)25(27,28)29;26-25(27,28)21-9-6-19(7-10-21)24-22(17-30-12-14-32-15-13-30)31-16-20(8-11-23(31)29-24)18-4-2-1-3-5-18;24-19-8-6-18(7-9-19)23-21(16-27-12-14-29-15-13-27)28-22(25-23)11-10-20(26-28)17-4-2-1-3-5-17;23-19-4-1-16(2-5-19)22-20(14-27-7-9-29-10-8-27)28-13-17(3-6-21(28)26-22)18-11-24-15-25-12-18;23-14-17-18(13-21-8-10-24-11-9-21)22-12-16(6-7-19(22)20-17)15-4-2-1-3-5-15/h1-10,15H,11-14,16H2;1-11,16H,12-15,17H2;1-11H,12-16H2;1-6,11-13,15H,7-10,14H2;1-7,12,23H,8-11,13-14H2.

What are the key properties of 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?

4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine has a molecular weight of 2043.56 g/mol, XLogP of 22.51, 20 rotatable bonds, 1 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-b]pyridazin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]methanol;4-[[6-phenyl-2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine is sourced from PubChem (CID 160677122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).