6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

C84H104B4Br2N12O8 — CID 159072007

About 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (PubChem CID 159072007) has the molecular formula C84H104B4Br2N12O8 and a molecular weight of 1612.89 g/mol. Its IUPAC name is 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.

Molecular Properties

• Compound Name: 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• PubChem CID: 159072007
• Molecular Formula: C84H104B4Br2N12O8
• Molecular Weight: 1612.89 g/mol
• Exact Mass: 1610.68
• IUPAC Name: 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• SMILES: CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CCc1cc(B2OC(C)(C)C(C)(C)O2)cc2c1cnn2-c1cccc(C)n1.CCc1cc(B2OC(C)(C)C(C)(C)O2)cc2nn(-c3cccc(C)n3)cc12.CCc1cc(Br)cc2c1cnn2-c1cccc(C)n1.CCc1cc(Br)cc2nn(-c3cccc(C)n3)cc12
• InChI: InChI=1S/2C21H26BN3O2.2C15H14BrN3.C12H24B2O4/c1-7-15-11-16(22-26-20(3,4)21(5,6)27-22)12-18-17(15)13-25(24-18)19-10-8-9-14(2)23-19;1-7-15-11-16(22-26-20(3,4)21(5,6)27-22)12-18-17(15)13-23-25(18)19-10-8-9-14(2)24-19;1-3-11-7-12(16)8-14-13(11)9-19(18-14)15-6-4-5-10(2)17-15;1-3-11-7-12(16)8-14-13(11)9-17-19(14)15-6-4-5-10(2)18-15;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14/h2*8-13H,7H2,1-6H3;2*4-9H,3H2,1-2H3;1-8H3
• InChIKey: JZTRHQJHPQMICP-UHFFFAOYSA-N
• XLogP: 17.54
• TPSA: 196.68 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 11
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1612.89
LogP ≤ 5	17.54
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The IUPAC name of 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (CID 159072007) is 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.

What is the SMILES notation for 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The canonical SMILES for 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CCc1cc(B2OC(C)(C)C(C)(C)O2)cc2c1cnn2-c1cccc(C)n1.CCc1cc(B2OC(C)(C)C(C)(C)O2)cc2nn(-c3cccc(C)n3)cc12.CCc1cc(Br)cc2c1cnn2-c1cccc(C)n1.CCc1cc(Br)cc2nn(-c3cccc(C)n3)cc12.

What is the InChIKey of 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The InChIKey is JZTRHQJHPQMICP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C21H26BN3O2.2C15H14BrN3.C12H24B2O4/c1-7-15-11-16(22-26-20(3,4)21(5,6)27-22)12-18-17(15)13-25(24-18)19-10-8-9-14(2)23-19;1-7-15-11-16(22-26-20(3,4)21(5,6)27-22)12-18-17(15)13-23-25(18)19-10-8-9-14(2)24-19;1-3-11-7-12(16)8-14-13(11)9-19(18-14)15-6-4-5-10(2)17-15;1-3-11-7-12(16)8-14-13(11)9-17-19(14)15-6-4-5-10(2)18-15;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14/h2*8-13H,7H2,1-6H3;2*4-9H,3H2,1-2H3;1-8H3.

What are the key properties of 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane has a molecular weight of 1612.89 g/mol, XLogP of 17.54, 11 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 6-bromo-4-ethyl-1-(6-methyl-2-pyridinyl)indazole;6-bromo-4-ethyl-2-(6-methyl-2-pyridinyl)indazole;4-ethyl-1-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-ethyl-2-(6-methyl-2-pyridinyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is sourced from PubChem (CID 159072007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).