6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine

C84H97BBr3ClN22O8 — CID 159606500

About 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine

6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine (PubChem CID 159606500) has the molecular formula C84H97BBr3ClN22O8 and a molecular weight of 1828.82 g/mol. Its IUPAC name is 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine.

Molecular Properties

• Compound Name: 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine
• PubChem CID: 159606500
• Molecular Formula: C84H97BBr3ClN22O8
• Molecular Weight: 1828.82 g/mol
• Exact Mass: 1824.52
• IUPAC Name: 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine
• SMILES: C[C@@H]1COCCN1.C[C@@H]1COCCN1c1nc(Br)cc2[nH]cnc12.C[C@@H]1COCCN1c1nc(Br)cc2[nH]cnc12.Cc1ccc(NC(=O)c2ccnc(C(C)(C)C#N)c2)cc1-c1cc2[nH]cnc2c(N2CCOC[C@H]2C)n1.Cc1ccc(NC(=O)c2ccnc(C(C)(C)C#N)c2)cc1B1OC(C)(C)C(C)(C)O1.Clc1nc(Br)cc2[nH]cnc12
• InChI: InChI=1S/C28H29N7O2.C23H28BN3O3.2C11H13BrN4O.C6H3BrClN3.C5H11NO/c1-17-5-6-20(33-27(36)19-7-8-30-24(11-19)28(3,4)15-29)12-21(17)22-13-23-25(32-16-31-23)26(34-22)35-9-10-37-14-18(35)2;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;2*1-7-5-17-3-2-16(7)11-10-8(13-6-14-10)4-9(12)15-11;7-4-1-3-5(6(8)11-4)10-2-9-3;1-5-4-7-3-2-6-5/h5-8,11-13,16,18H,9-10,14H2,1-4H3,(H,31,32)(H,33,36);8-13H,1-7H3,(H,27,28);2*4,6-7H,2-3,5H2,1H3,(H,13,14);1-2H,(H,9,10);5-6H,2-4H2,1H3/t18-;;2*7-;;5-/m1.11.1/s1
• InChIKey: MMDMUZXZOPQVIS-OHZFGGGYSA-N
• XLogP: 14.61
• TPSA: 374.97 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 24
• Rotatable Bonds: 11
• Heavy Atoms: 119
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1828.82
LogP ≤ 5	14.61
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine?

The IUPAC name of 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine (CID 159606500) is 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine.

What is the SMILES notation for 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine?

The canonical SMILES for 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine is C[C@@H]1COCCN1.C[C@@H]1COCCN1c1nc(Br)cc2[nH]cnc12.C[C@@H]1COCCN1c1nc(Br)cc2[nH]cnc12.Cc1ccc(NC(=O)c2ccnc(C(C)(C)C#N)c2)cc1-c1cc2[nH]cnc2c(N2CCOC[C@H]2C)n1.Cc1ccc(NC(=O)c2ccnc(C(C)(C)C#N)c2)cc1B1OC(C)(C)C(C)(C)O1.Clc1nc(Br)cc2[nH]cnc12.

What is the InChIKey of 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine?

The InChIKey is MMDMUZXZOPQVIS-OHZFGGGYSA-N. The full InChI is InChI=1S/C28H29N7O2.C23H28BN3O3.2C11H13BrN4O.C6H3BrClN3.C5H11NO/c1-17-5-6-20(33-27(36)19-7-8-30-24(11-19)28(3,4)15-29)12-21(17)22-13-23-25(32-16-31-23)26(34-22)35-9-10-37-14-18(35)2;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;2*1-7-5-17-3-2-16(7)11-10-8(13-6-14-10)4-9(12)15-11;7-4-1-3-5(6(8)11-4)10-2-9-3;1-5-4-7-3-2-6-5/h5-8,11-13,16,18H,9-10,14H2,1-4H3,(H,31,32)(H,33,36);8-13H,1-7H3,(H,27,28);2*4,6-7H,2-3,5H2,1H3,(H,13,14);1-2H,(H,9,10);5-6H,2-4H2,1H3/t18-;;2*7-;;5-/m1.11.1/s1.

What are the key properties of 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine?

6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine has a molecular weight of 1828.82 g/mol, XLogP of 14.61, 11 rotatable bonds, 7 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 6-bromo-4-chloro-1H-imidazo[4,5-c]pyridine;bis((3R)-4-(6-bromo-1H-imidazo[4,5-c]pyridin-4-yl)-3-methylmorpholine);2-(2-cyanopropan-2-yl)-N-[4-methyl-3-[4-[(3R)-3-methylmorpholin-4-yl]-1H-imidazo[4,5-c]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;(3R)-3-methylmorpholine is sourced from PubChem (CID 159606500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).