4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide

C62H68BClN12O6 — CID 159350337

About 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide

4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide (PubChem CID 159350337) has the molecular formula C62H68BClN12O6 and a molecular weight of 1123.57 g/mol. Its IUPAC name is 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide
• PubChem CID: 159350337
• Molecular Formula: C62H68BClN12O6
• Molecular Weight: 1123.57 g/mol
• Exact Mass: 1122.52
• IUPAC Name: 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide
• SMILES: Cc1ccc(NC(=O)c2ccnc(C(C)(C)C#N)c2)cc1-c1cc(N2CCOCC2)c2nccn2c1.Cc1ccc(NC(=O)c2ccnc(C(C)(C)C#N)c2)cc1B1OC(C)(C)C(C)(C)O1.Clc1cc(N2CCOCC2)c2nccn2c1
• InChI: InChI=1S/C28H28N6O2.C23H28BN3O3.C11H12ClN3O/c1-19-4-5-22(32-27(35)20-6-7-30-25(15-20)28(2,3)18-29)16-23(19)21-14-24(33-10-12-36-13-11-33)26-31-8-9-34(26)17-21;1-15-8-9-17(13-18(15)24-29-22(4,5)23(6,7)30-24)27-20(28)16-10-11-26-19(12-16)21(2,3)14-25;12-9-7-10(14-3-5-16-6-4-14)11-13-1-2-15(11)8-9/h4-9,14-17H,10-13H2,1-3H3,(H,32,35);8-13H,1-7H3,(H,27,28);1-2,7-8H,3-6H2
• InChIKey: LHFZQVKRJNWNGB-UHFFFAOYSA-N
• XLogP: 10.16
• TPSA: 209.56 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 16
• Rotatable Bonds: 10
• Heavy Atoms: 82
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1123.57
LogP ≤ 5	10.16
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide?

The IUPAC name of 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide (CID 159350337) is 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide.

What is the SMILES notation for 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide?

The canonical SMILES for 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide is Cc1ccc(NC(=O)c2ccnc(C(C)(C)C#N)c2)cc1-c1cc(N2CCOCC2)c2nccn2c1.Cc1ccc(NC(=O)c2ccnc(C(C)(C)C#N)c2)cc1B1OC(C)(C)C(C)(C)O1.Clc1cc(N2CCOCC2)c2nccn2c1.

What is the InChIKey of 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide?

The InChIKey is LHFZQVKRJNWNGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28N6O2.C23H28BN3O3.C11H12ClN3O/c1-19-4-5-22(32-27(35)20-6-7-30-25(15-20)28(2,3)18-29)16-23(19)21-14-24(33-10-12-36-13-11-33)26-31-8-9-34(26)17-21;1-15-8-9-17(13-18(15)24-29-22(4,5)23(6,7)30-24)27-20(28)16-10-11-26-19(12-16)21(2,3)14-25;12-9-7-10(14-3-5-16-6-4-14)11-13-1-2-15(11)8-9/h4-9,14-17H,10-13H2,1-3H3,(H,32,35);8-13H,1-7H3,(H,27,28);1-2,7-8H,3-6H2.

What are the key properties of 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide?

4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide has a molecular weight of 1123.57 g/mol, XLogP of 10.16, 10 rotatable bonds, 2 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(6-chloroimidazo[1,2-a]pyridin-8-yl)morpholine;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-a]pyridin-6-yl)phenyl]pyridine-4-carboxamide;2-(2-cyanopropan-2-yl)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 159350337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).