4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid

C92H90BBrClN17O13 — CID 159710680

About 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid

4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 159710680) has the molecular formula C92H90BBrClN17O13 and a molecular weight of 1768.01 g/mol. Its IUPAC name is 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

• Compound Name: 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid
• PubChem CID: 159710680
• Molecular Formula: C92H90BBrClN17O13
• Molecular Weight: 1768.01 g/mol
• Exact Mass: 1765.59
• IUPAC Name: 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid
• SMILES: CCOC(=O)c1c(-c2ccccc2)nc2c(-c3cc(N4CCOCC4)ncn3)cccn12.CCOC(=O)c1c(-c2ccccc2)nc2c(B3OC(C)(C)C(C)(C)O3)cccn12.CCOC(=O)c1c(-c2ccccc2)nc2c(Br)cccn12.Clc1cc(N2CCOCC2)ncn1.O=C(O)c1c(-c2ccccc2)nc2c(-c3cc(N4CCOCC4)ncn3)cccn12
• InChI: InChI=1S/C24H23N5O3.C22H25BN2O4.C22H19N5O3.C16H13BrN2O2.C8H10ClN3O/c1-2-32-24(30)22-21(17-7-4-3-5-8-17)27-23-18(9-6-10-29(22)23)19-15-20(26-16-25-19)28-11-13-31-14-12-28;1-6-27-20(26)18-17(15-11-8-7-9-12-15)24-19-16(13-10-14-25(18)19)23-28-21(2,3)22(4,5)29-23;28-22(29)20-19(15-5-2-1-3-6-15)25-21-16(7-4-8-27(20)21)17-13-18(24-14-23-17)26-9-11-30-12-10-26;1-2-21-16(20)14-13(11-7-4-3-5-8-11)18-15-12(17)9-6-10-19(14)15;9-7-5-8(11-6-10-7)12-1-3-13-4-2-12/h3-10,15-16H,2,11-14H2,1H3;7-14H,6H2,1-5H3;1-8,13-14H,9-12H2,(H,28,29);3-10H,2H2,1H3;5-6H,1-4H2
• InChIKey: MYUIOKLIYRRHKG-UHFFFAOYSA-N
• XLogP: 14.85
• TPSA: 318.61 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 29
• Rotatable Bonds: 17
• Heavy Atoms: 125
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1768.01
LogP ≤ 5	14.85
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid?

The IUPAC name of 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid (CID 159710680) is 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid.

What is the SMILES notation for 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid?

The canonical SMILES for 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid is CCOC(=O)c1c(-c2ccccc2)nc2c(-c3cc(N4CCOCC4)ncn3)cccn12.CCOC(=O)c1c(-c2ccccc2)nc2c(B3OC(C)(C)C(C)(C)O3)cccn12.CCOC(=O)c1c(-c2ccccc2)nc2c(Br)cccn12.Clc1cc(N2CCOCC2)ncn1.O=C(O)c1c(-c2ccccc2)nc2c(-c3cc(N4CCOCC4)ncn3)cccn12.

What is the InChIKey of 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid?

The InChIKey is MYUIOKLIYRRHKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O3.C22H25BN2O4.C22H19N5O3.C16H13BrN2O2.C8H10ClN3O/c1-2-32-24(30)22-21(17-7-4-3-5-8-17)27-23-18(9-6-10-29(22)23)19-15-20(26-16-25-19)28-11-13-31-14-12-28;1-6-27-20(26)18-17(15-11-8-7-9-12-15)24-19-16(13-10-14-25(18)19)23-28-21(2,3)22(4,5)29-23;28-22(29)20-19(15-5-2-1-3-6-15)25-21-16(7-4-8-27(20)21)17-13-18(24-14-23-17)26-9-11-30-12-10-26;1-2-21-16(20)14-13(11-7-4-3-5-8-11)18-15-12(17)9-6-10-19(14)15;9-7-5-8(11-6-10-7)12-1-3-13-4-2-12/h3-10,15-16H,2,11-14H2,1H3;7-14H,6H2,1-5H3;1-8,13-14H,9-12H2,(H,28,29);3-10H,2H2,1H3;5-6H,1-4H2.

What are the key properties of 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid?

4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 1768.01 g/mol, XLogP of 14.85, 17 rotatable bonds, 1 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(6-chloropyrimidin-4-yl)morpholine;ethyl 8-bromo-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylate;ethyl 2-phenyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate;8-(6-morpholin-4-ylpyrimidin-4-yl)-2-phenylimidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 159710680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).