N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

C78H76BClF8IN9O14Si — CID 158341620

About N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine (PubChem CID 158341620) has the molecular formula C78H76BClF8IN9O14Si and a molecular weight of 1716.75 g/mol. Its IUPAC name is N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine.

Molecular Properties

• Compound Name: N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
• PubChem CID: 158341620
• Molecular Formula: C78H76BClF8IN9O14Si
• Molecular Weight: 1716.75 g/mol
• Exact Mass: 1715.40
• IUPAC Name: N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
• SMILES: COc1ncc(C)cc1B1OC(C)(C)C(C)(C)O1.COc1ncc(F)cc1-c1nc(NC(=O)C2(c3ccc4c(c3)OC(F)(F)O4)CC2)ccc1C.C[Si](C)(C)I.Cc1ccc(NC(=O)C2(c3ccc4c(c3)OC(F)(F)O4)CC2)nc1-c1cc(F)c[nH]c1=O.Cc1ccc(NC(=O)C2(c3ccc4c(c3)OC(F)(F)O4)CC2)nc1Cl
• InChI: InChI=1S/C23H18F3N3O4.C22H16F3N3O4.C17H13ClF2N2O3.C13H20BNO3.C3H9ISi/c1-12-3-6-18(28-19(12)15-10-14(24)11-27-20(15)31-2)29-21(30)22(7-8-22)13-4-5-16-17(9-13)33-23(25,26)32-16;1-11-2-5-17(27-18(11)14-9-13(23)10-26-19(14)29)28-20(30)21(6-7-21)12-3-4-15-16(8-12)32-22(24,25)31-15;1-9-2-5-13(21-14(9)18)22-15(23)16(6-7-16)10-3-4-11-12(8-10)25-17(19,20)24-11;1-9-7-10(11(16-6)15-8-9)14-17-12(2,3)13(4,5)18-14;1-5(2,3)4/h3-6,9-11H,7-8H2,1-2H3,(H,28,29,30);2-5,8-10H,6-7H2,1H3,(H,26,29)(H,27,28,30);2-5,8H,6-7H2,1H3,(H,21,22,23);7-8H,1-6H3;1-3H3
• InChIKey: GRFRSHVLWXVHPT-UHFFFAOYSA-N
• XLogP: 16.46
• TPSA: 276.91 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 19
• Rotatable Bonds: 14
• Heavy Atoms: 113
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1716.75
LogP ≤ 5	16.46
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine?

The IUPAC name of N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine (CID 158341620) is N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine.

What is the SMILES notation for N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine?

The canonical SMILES for N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine is COc1ncc(C)cc1B1OC(C)(C)C(C)(C)O1.COc1ncc(F)cc1-c1nc(NC(=O)C2(c3ccc4c(c3)OC(F)(F)O4)CC2)ccc1C.C[Si](C)(C)I.Cc1ccc(NC(=O)C2(c3ccc4c(c3)OC(F)(F)O4)CC2)nc1-c1cc(F)c[nH]c1=O.Cc1ccc(NC(=O)C2(c3ccc4c(c3)OC(F)(F)O4)CC2)nc1Cl.

What is the InChIKey of N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine?

The InChIKey is GRFRSHVLWXVHPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18F3N3O4.C22H16F3N3O4.C17H13ClF2N2O3.C13H20BNO3.C3H9ISi/c1-12-3-6-18(28-19(12)15-10-14(24)11-27-20(15)31-2)29-21(30)22(7-8-22)13-4-5-16-17(9-13)33-23(25,26)32-16;1-11-2-5-17(27-18(11)14-9-13(23)10-26-19(14)29)28-20(30)21(6-7-21)12-3-4-15-16(8-12)32-22(24,25)31-15;1-9-2-5-13(21-14(9)18)22-15(23)16(6-7-16)10-3-4-11-12(8-10)25-17(19,20)24-11;1-9-7-10(11(16-6)15-8-9)14-17-12(2,3)13(4,5)18-14;1-5(2,3)4/h3-6,9-11H,7-8H2,1-2H3,(H,28,29,30);2-5,8-10H,6-7H2,1H3,(H,26,29)(H,27,28,30);2-5,8H,6-7H2,1H3,(H,21,22,23);7-8H,1-6H3;1-3H3.

What are the key properties of N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine?

N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine has a molecular weight of 1716.75 g/mol, XLogP of 16.46, 14 rotatable bonds, 4 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for N-(6-chloro-5-methyl-2-pyridinyl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-methoxy-3-pyridinyl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[6-(5-fluoro-2-oxo-1H-pyridin-3-yl)-5-methyl-2-pyridinyl]cyclopropane-1-carboxamide;iodo(trimethyl)silane;2-methoxy-5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine is sourced from PubChem (CID 158341620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).