4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane

C80H97B3Br2F7N21O6 — CID 159206636

About 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane

4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane (PubChem CID 159206636) has the molecular formula C80H97B3Br2F7N21O6 and a molecular weight of 1774.03 g/mol. Its IUPAC name is 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane.

Molecular Properties

• Compound Name: 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane
• PubChem CID: 159206636
• Molecular Formula: C80H97B3Br2F7N21O6
• Molecular Weight: 1774.03 g/mol
• Exact Mass: 1771.65
• IUPAC Name: 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane
• SMILES: CC1(C)OB(CB2OC(C)(C)C(C)(C)O2)OC1(C)C.CC1(C)OB(c2cc(F)nc(F)c2)OC1(C)C.CCC(C)c1cc(Br)ccn1.Cn1nccc1N.Cn1nccc1Nc1cc(-c2cc(F)nc(CN)c2)ccn1.Cn1nccc1Nc1cc(-c2cc(F)nc(F)c2)ccn1.Cn1nccc1Nc1cc(Br)ccn1.Fc1cccc(F)n1
• InChI: InChI=1S/C15H15FN6.C14H11F2N5.C13H26B2O4.C11H14BF2NO2.C9H9BrN4.C9H12BrN.C5H3F2N.C4H7N3/c1-22-15(3-5-19-22)21-14-8-10(2-4-18-14)11-6-12(9-17)20-13(16)7-11;1-21-14(3-5-18-21)20-13-8-9(2-4-17-13)10-6-11(15)19-12(16)7-10;1-10(2)11(3,4)17-14(16-10)9-15-18-12(5,6)13(7,8)19-15;1-10(2)11(3,4)17-12(16-10)7-5-8(13)15-9(14)6-7;1-14-9(3-5-12-14)13-8-6-7(10)2-4-11-8;1-3-7(2)9-6-8(10)4-5-11-9;6-4-2-1-3-5(7)8-4;1-7-4(5)2-3-6-7/h2-8H,9,17H2,1H3,(H,18,21);2-8H,1H3,(H,17,20);9H2,1-8H3;5-6H,1-4H3;2-6H,1H3,(H,11,13);4-7H,3H2,1-2H3;1-3H;2-3H,5H2,1H3
• InChIKey: KPYVTICKPVVVBO-UHFFFAOYSA-N
• XLogP: 16.53
• TPSA: 317.91 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 27
• Rotatable Bonds: 14
• Heavy Atoms: 119
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1774.03
LogP ≤ 5	16.53
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	27

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 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane?

The IUPAC name of 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane (CID 159206636) is 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane.

What is the SMILES notation for 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane?

The canonical SMILES for 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane is CC1(C)OB(CB2OC(C)(C)C(C)(C)O2)OC1(C)C.CC1(C)OB(c2cc(F)nc(F)c2)OC1(C)C.CCC(C)c1cc(Br)ccn1.Cn1nccc1N.Cn1nccc1Nc1cc(-c2cc(F)nc(CN)c2)ccn1.Cn1nccc1Nc1cc(-c2cc(F)nc(F)c2)ccn1.Cn1nccc1Nc1cc(Br)ccn1.Fc1cccc(F)n1.

What is the InChIKey of 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane?

The InChIKey is KPYVTICKPVVVBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN6.C14H11F2N5.C13H26B2O4.C11H14BF2NO2.C9H9BrN4.C9H12BrN.C5H3F2N.C4H7N3/c1-22-15(3-5-19-22)21-14-8-10(2-4-18-14)11-6-12(9-17)20-13(16)7-11;1-21-14(3-5-18-21)20-13-8-9(2-4-17-13)10-6-11(15)19-12(16)7-10;1-10(2)11(3,4)17-14(16-10)9-15-18-12(5,6)13(7,8)19-15;1-10(2)11(3,4)17-12(16-10)7-5-8(13)15-9(14)6-7;1-14-9(3-5-12-14)13-8-6-7(10)2-4-11-8;1-3-7(2)9-6-8(10)4-5-11-9;6-4-2-1-3-5(7)8-4;1-7-4(5)2-3-6-7/h2-8H,9,17H2,1H3,(H,18,21);2-8H,1H3,(H,17,20);9H2,1-8H3;5-6H,1-4H3;2-6H,1H3,(H,11,13);4-7H,3H2,1-2H3;1-3H;2-3H,5H2,1H3.

What are the key properties of 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane?

4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane has a molecular weight of 1774.03 g/mol, XLogP of 16.53, 14 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2-(aminomethyl)-6-fluoro-4-pyridinyl]-N-(2-methylpyrazol-3-yl)pyridin-2-amine;4-bromo-2-butan-2-ylpyridine;4-bromo-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoropyridine;4-(2,6-difluoro-4-pyridinyl)-N-(2-methylpyrazol-3-yl)pyridin-2-amine;2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;2-methylpyrazol-3-amine;4,4,5,5-tetramethyl-2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,3,2-dioxaborolane is sourced from PubChem (CID 159206636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).