5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane

C73H74B2Br4Cl3F6N23O9 — CID 158025888

About 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane

5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane (PubChem CID 158025888) has the molecular formula C73H74B2Br4Cl3F6N23O9 and a molecular weight of 1979.13 g/mol. Its IUPAC name is 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane.

Molecular Properties

• Compound Name: 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane
• PubChem CID: 158025888
• Molecular Formula: C73H74B2Br4Cl3F6N23O9
• Molecular Weight: 1979.13 g/mol
• Exact Mass: 1973.19
• IUPAC Name: 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane
• SMILES: Cc1cc(-c2c(-c3ccc(C)o3)nc(N)n3cnnc23)cc(C(F)(F)F)n1.Cc1cc(B2OC(C)(C)C(C)(C)O2)cc(C(F)(F)F)n1.Cc1ccc(-c2nc(N)n3cnnc3c2Br)o1.Cc1ccc(-c2nc(N)nc(Cl)c2Br)o1.Cc1ccc(-c2nc(N)nc(NN)c2Br)o1.Cc1ccc(B2OC(C)(C)C(C)(C)O2)o1.Nc1nc(Cl)c(Br)c(Cl)n1
• InChI: InChI=1S/C17H13F3N6O.C13H17BF3NO2.C11H17BO3.C10H8BrN5O.C9H7BrClN3O.C9H10BrN5O.C4H2BrCl2N3/c1-8-5-10(6-12(23-8)17(18,19)20)13-14(11-4-3-9(2)27-11)24-16(21)26-7-22-25-15(13)26;1-8-6-9(7-10(18-8)13(15,16)17)14-19-11(2,3)12(4,5)20-14;1-8-6-7-9(13-8)12-14-10(2,3)11(4,5)15-12;1-5-2-3-6(17-5)8-7(11)9-15-13-4-16(9)10(12)14-8;1-4-2-3-5(15-4)7-6(10)8(11)14-9(12)13-7;1-4-2-3-5(16-4)7-6(10)8(15-12)14-9(11)13-7;5-1-2(6)9-4(8)10-3(1)7/h3-7H,1-2H3,(H2,21,24);6-7H,1-5H3;6-7H,1-5H3;2-4H,1H3,(H2,12,14);2-3H,1H3,(H2,12,13,14);2-3H,12H2,1H3,(H3,11,13,14,15);(H2,8,9,10)
• InChIKey: FGPGNUZWEQMUNL-UHFFFAOYSA-N
• XLogP: 17.14
• TPSA: 460.05 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 32
• Rotatable Bonds: 8
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1979.13
LogP ≤ 5	17.14
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane?

The IUPAC name of 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane (CID 158025888) is 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane.

What is the SMILES notation for 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane?

The canonical SMILES for 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane is Cc1cc(-c2c(-c3ccc(C)o3)nc(N)n3cnnc23)cc(C(F)(F)F)n1.Cc1cc(B2OC(C)(C)C(C)(C)O2)cc(C(F)(F)F)n1.Cc1ccc(-c2nc(N)n3cnnc3c2Br)o1.Cc1ccc(-c2nc(N)nc(Cl)c2Br)o1.Cc1ccc(-c2nc(N)nc(NN)c2Br)o1.Cc1ccc(B2OC(C)(C)C(C)(C)O2)o1.Nc1nc(Cl)c(Br)c(Cl)n1.

What is the InChIKey of 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane?

The InChIKey is FGPGNUZWEQMUNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F3N6O.C13H17BF3NO2.C11H17BO3.C10H8BrN5O.C9H7BrClN3O.C9H10BrN5O.C4H2BrCl2N3/c1-8-5-10(6-12(23-8)17(18,19)20)13-14(11-4-3-9(2)27-11)24-16(21)26-7-22-25-15(13)26;1-8-6-9(7-10(18-8)13(15,16)17)14-19-11(2,3)12(4,5)20-14;1-8-6-7-9(13-8)12-14-10(2,3)11(4,5)15-12;1-5-2-3-6(17-5)8-7(11)9-15-13-4-16(9)10(12)14-8;1-4-2-3-5(15-4)7-6(10)8(11)14-9(12)13-7;1-4-2-3-5(16-4)7-6(10)8(15-12)14-9(11)13-7;5-1-2(6)9-4(8)10-3(1)7/h3-7H,1-2H3,(H2,21,24);6-7H,1-5H3;6-7H,1-5H3;2-4H,1H3,(H2,12,14);2-3H,1H3,(H2,12,13,14);2-3H,12H2,1H3,(H3,11,13,14,15);(H2,8,9,10).

What are the key properties of 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane?

5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane has a molecular weight of 1979.13 g/mol, XLogP of 17.14, 8 rotatable bonds, 7 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-4-chloro-6-(5-methylfuran-2-yl)pyrimidin-2-amine;5-bromo-4,6-dichloropyrimidin-2-amine;5-bromo-4-hydrazinyl-6-(5-methylfuran-2-yl)pyrimidin-2-amine;8-bromo-7-(5-methylfuran-2-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(5-methylfuran-2-yl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine;4,4,5,5-tetramethyl-2-(5-methylfuran-2-yl)-1,3,2-dioxaborolane is sourced from PubChem (CID 158025888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).