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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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

C133H127Cl2F3N22O10 — CID 159148353

IUPAC4-[[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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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
SMILESClc1ccc(-c2nc3ccc(-c4ccccc4)nn3c2CN2CCOCC2)cc1.Clc1ccc(-c2nc3ccc(-c4cncnc4)cn3c2CN2CCOCC2)cc1.FC(F)(F)c1ccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCOCC2)cc1.NC(=O)c1ccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCOCC2)cc1.O=C(O)c1nc2ccc(-c3ccccc3)cn2c1CN1CCOCC1.OCc1nc2ccc(-c3ccccc3)cn2c1CN1CCOCC1
InChIInChI=1S/C25H22F3N3O.C25H24N4O2.C23H21ClN4O.C22H20ClN5O.C19H19N3O3.C19H21N3O2/c26-25(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;26-25(30)20-8-6-19(7-9-20)24-22(17-28-12-14-31-15-13-28)29-16-21(10-11-23(29)27-24)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;23-19(24)18-16(13-21-8-10-25-11-9-21)22-12-15(6-7-17(22)20-18)14-4-2-1-3-5-14;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/h1-11,16H,12-15,17H2;1-11,16H,12-15,17H2,(H2,26,30);1-11H,12-16H2;1-6,11-13,15H,7-10,14H2;1-7,12H,8-11,13H2,(H,23,24);1-7,12,23H,8-11,13-14H2
InChIKeyKIYSLVIKOFUXGD-UHFFFAOYSA-N
MW2321.52 g/mol
LogP22.47
Rot. Bonds25

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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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 159148353) has the molecular formula C133H127Cl2F3N22O10 and a molecular weight of 2321.52 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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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 Name4-[[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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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 CID159148353
Molecular FormulaC133H127Cl2F3N22O10
Molecular Weight2321.52 g/mol
Exact Mass2318.94
IUPAC Name4-[[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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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
SMILESClc1ccc(-c2nc3ccc(-c4ccccc4)nn3c2CN2CCOCC2)cc1.Clc1ccc(-c2nc3ccc(-c4cncnc4)cn3c2CN2CCOCC2)cc1.FC(F)(F)c1ccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCOCC2)cc1.NC(=O)c1ccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCOCC2)cc1.O=C(O)c1nc2ccc(-c3ccccc3)cn2c1CN1CCOCC1.OCc1nc2ccc(-c3ccccc3)cn2c1CN1CCOCC1
InChIInChI=1S/C25H22F3N3O.C25H24N4O2.C23H21ClN4O.C22H20ClN5O.C19H19N3O3.C19H21N3O2/c26-25(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;26-25(30)20-8-6-19(7-9-20)24-22(17-28-12-14-31-15-13-28)29-16-21(10-11-23(29)27-24)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;23-19(24)18-16(13-21-8-10-25-11-9-21)22-12-15(6-7-17(22)20-18)14-4-2-1-3-5-14;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/h1-11,16H,12-15,17H2;1-11,16H,12-15,17H2,(H2,26,30);1-11H,12-16H2;1-6,11-13,15H,7-10,14H2;1-7,12H,8-11,13H2,(H,23,24);1-7,12,23H,8-11,13-14H2
InChIKeyKIYSLVIKOFUXGD-UHFFFAOYSA-N
XLogP22.47
TPSA317.91 Ų
H-Bond Donors3
H-Bond Acceptors30
Rotatable Bonds25
Heavy Atoms170
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002321.52
LogP ≤ 522.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1030

Analyze 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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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 with MolForge

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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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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 159148353) 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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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.NC(=O)c1ccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCOCC2)cc1.O=C(O)c1nc2ccc(-c3ccccc3)cn2c1CN1CCOCC1.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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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 KIYSLVIKOFUXGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22F3N3O.C25H24N4O2.C23H21ClN4O.C22H20ClN5O.C19H19N3O3.C19H21N3O2/c26-25(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;26-25(30)20-8-6-19(7-9-20)24-22(17-28-12-14-31-15-13-28)29-16-21(10-11-23(29)27-24)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;23-19(24)18-16(13-21-8-10-25-11-9-21)22-12-15(6-7-17(22)20-18)14-4-2-1-3-5-14;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/h1-11,16H,12-15,17H2;1-11,16H,12-15,17H2,(H2,26,30);1-11H,12-16H2;1-6,11-13,15H,7-10,14H2;1-7,12H,8-11,13H2,(H,23,24);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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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 2321.52 g/mol, XLogP of 22.47, 25 rotatable bonds, 3 hydrogen bond donors, and 30 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;3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxylic acid;4-[3-(morpholin-4-ylmethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl]benzamide;[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 159148353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).