2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+)

C96H78BrF12N21O3Pt — CID 159083223

About 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+)

2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+) (PubChem CID 159083223) has the molecular formula C96H78BrF12N21O3Pt and a molecular weight of 2076.78 g/mol. Its IUPAC name is 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+).

Molecular Properties

• Compound Name: 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+)
• PubChem CID: 159083223
• Molecular Formula: C96H78BrF12N21O3Pt
• Molecular Weight: 2076.78 g/mol
• Exact Mass: 2074.52
• IUPAC Name: 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+)
• SMILES: Cc1cc(-c2cccc(-c3cccc(-c4cccc(-c5cc(C(F)(F)F)[nH]n5)n4)c3)n2)n[nH]1.Cc1cc(-c2cccc(-c3cccc(-c4cccc(-c5cc(C(F)(F)F)n[n-]5)n4)c3)n2)[n-]n1.Cc1cc(-c2cccc(-c3cccc(-c4cccc(-c5cc(C(F)(F)F)nn5C5CCCCO5)n4)c3)n2)n(C2CCCCO2)n1.FC(F)(F)c1cc(-c2cccc(Br)n2)n(C2CCCCO2)n1.[Pt+2]
• InChI: InChI=1S/C34H33F3N6O2.C24H17F3N6.C24H15F3N6.C14H13BrF3N3O.Pt/c1-22-19-29(42(40-22)32-15-2-4-17-44-32)27-13-7-11-25(38-27)23-9-6-10-24(20-23)26-12-8-14-28(39-26)30-21-31(34(35,36)37)41-43(30)33-16-3-5-18-45-33;2*1-14-11-21(31-30-14)19-9-3-7-17(28-19)15-5-2-6-16(12-15)18-8-4-10-20(29-18)22-13-23(33-32-22)24(25,26)27;15-12-5-3-4-9(19-12)10-8-11(14(16,17)18)20-21(10)13-6-1-2-7-22-13;/h6-14,19-21,32-33H,2-5,15-18H2,1H3;2-13H,1H3,(H,30,31)(H,32,33);2-13H,1H3;3-5,8,13H,1-2,6-7H2;/q;;-2;;+2
• InChIKey: KBCRUVIVSJZJAE-UHFFFAOYSA-N
• XLogP: 23.78
• TPSA: 282.72 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 20
• Rotatable Bonds: 16
• Heavy Atoms: 134
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2076.78
LogP ≤ 5	23.78
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+)?

The IUPAC name of 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+) (CID 159083223) is 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+).

What is the SMILES notation for 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+)?

The canonical SMILES for 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+) is Cc1cc(-c2cccc(-c3cccc(-c4cccc(-c5cc(C(F)(F)F)[nH]n5)n4)c3)n2)n[nH]1.Cc1cc(-c2cccc(-c3cccc(-c4cccc(-c5cc(C(F)(F)F)n[n-]5)n4)c3)n2)[n-]n1.Cc1cc(-c2cccc(-c3cccc(-c4cccc(-c5cc(C(F)(F)F)nn5C5CCCCO5)n4)c3)n2)n(C2CCCCO2)n1.FC(F)(F)c1cc(-c2cccc(Br)n2)n(C2CCCCO2)n1.[Pt+2].

What is the InChIKey of 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+)?

The InChIKey is KBCRUVIVSJZJAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H33F3N6O2.C24H17F3N6.C24H15F3N6.C14H13BrF3N3O.Pt/c1-22-19-29(42(40-22)32-15-2-4-17-44-32)27-13-7-11-25(38-27)23-9-6-10-24(20-23)26-12-8-14-28(39-26)30-21-31(34(35,36)37)41-43(30)33-16-3-5-18-45-33;2*1-14-11-21(31-30-14)19-9-3-7-17(28-19)15-5-2-6-16(12-15)18-8-4-10-20(29-18)22-13-23(33-32-22)24(25,26)27;15-12-5-3-4-9(19-12)10-8-11(14(16,17)18)20-21(10)13-6-1-2-7-22-13;/h6-14,19-21,32-33H,2-5,15-18H2,1H3;2-13H,1H3,(H,30,31)(H,32,33);2-13H,1H3;3-5,8,13H,1-2,6-7H2;/q;;-2;;+2.

What are the key properties of 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+)?

2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+) has a molecular weight of 2076.78 g/mol, XLogP of 23.78, 16 rotatable bonds, 2 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;2-[5-methyl-2-(oxan-2-yl)pyrazol-3-yl]-6-[3-[6-[1-(oxan-2-yl)-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methylpyrazol-2-id-3-yl)-6-[3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine;platinum(2+) is sourced from PubChem (CID 159083223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).