2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine

C156H146F5Ir4N25 — CID 159149770

About 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine

2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine (PubChem CID 159149770) has the molecular formula C156H146F5Ir4N25 and a molecular weight of 3234.92 g/mol. Its IUPAC name is 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine.

Molecular Properties

• Compound Name: 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine
• PubChem CID: 159149770
• Molecular Formula: C156H146F5Ir4N25
• Molecular Weight: 3234.92 g/mol
• Exact Mass: 3236.06
• IUPAC Name: 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine
• SMILES: CC(C)(C)c1n[n-]c(-c2cccc(-c3[n-]nc(C(C)(C)C)c3-c3ccccc3)n2)c1-c1ccccc1.CC(C)(c1[c-]c(C(C)(C)c2ccccn2)ccc1)c1ccccn1.CC(C)(c1[c-]cccc1)c1cccc(C(C)(C)c2[c-]cccc2)n1.CC(C)(c1[c-]cccc1)c1cccc(C(C)(C)c2[c-]cccc2)n1.CCc1c(-c2ccccn2)[n-]c(-c2ccccn2)c1CC.Cc1n[n-]c(-c2cccc(-c3[n-]nc(C(F)(F)F)c3C)n2)c1C.Fc1cc(F)c(-n2cccn2)[c-]c1-n1cccn1.[Ir+3].[Ir+3].[Ir+3].[Ir+3].[c-]1c(-n2cccn2)cccc1-n1cccn1
• InChI: InChI=1S/C31H31N5.2C23H23N.C22H23N2.C18H18N3.C15H12F3N5.C12H7F2N4.C12H9N4.4Ir/c1-30(2,3)28-24(20-14-9-7-10-15-20)26(33-35-28)22-18-13-19-23(32-22)27-25(21-16-11-8-12-17-21)29(36-34-27)31(4,5)6;2*1-22(2,18-12-7-5-8-13-18)20-16-11-17-21(24-20)23(3,4)19-14-9-6-10-15-19;1-21(2,19-12-5-7-14-23-19)17-10-9-11-18(16-17)22(3,4)20-13-6-8-15-24-20;1-3-13-14(4-2)18(16-10-6-8-12-20-16)21-17(13)15-9-5-7-11-19-15;1-7-9(3)20-21-12(7)10-5-4-6-11(19-10)13-8(2)14(23-22-13)15(16,17)18;13-9-7-10(14)12(18-6-2-4-16-18)8-11(9)17-5-1-3-15-17;1-4-11(15-8-2-6-13-15)10-12(5-1)16-9-3-7-14-16;;;;/h7-19H,1-6H3;2*5-12,14,16-17H,1-4H3;5-15H,1-4H3;5-12H,3-4H2,1-2H3;4-6H,1-3H3;1-7H;1-9H;;;;/q3*-2;2*-1;-2;2*-1;4*+3
• InChIKey: YDEHHNHNCOYIHA-UHFFFAOYSA-N
• XLogP: 33.59
• TPSA: 296.46 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 26
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3234.92
LogP ≤ 5	33.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine?

The IUPAC name of 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine (CID 159149770) is 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine.

What is the SMILES notation for 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine?

The canonical SMILES for 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine is CC(C)(C)c1n[n-]c(-c2cccc(-c3[n-]nc(C(C)(C)C)c3-c3ccccc3)n2)c1-c1ccccc1.CC(C)(c1[c-]c(C(C)(C)c2ccccn2)ccc1)c1ccccn1.CC(C)(c1[c-]cccc1)c1cccc(C(C)(C)c2[c-]cccc2)n1.CC(C)(c1[c-]cccc1)c1cccc(C(C)(C)c2[c-]cccc2)n1.CCc1c(-c2ccccn2)[n-]c(-c2ccccn2)c1CC.Cc1n[n-]c(-c2cccc(-c3[n-]nc(C(F)(F)F)c3C)n2)c1C.Fc1cc(F)c(-n2cccn2)[c-]c1-n1cccn1.[Ir+3].[Ir+3].[Ir+3].[Ir+3].[c-]1c(-n2cccn2)cccc1-n1cccn1.

What is the InChIKey of 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine?

The InChIKey is YDEHHNHNCOYIHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H31N5.2C23H23N.C22H23N2.C18H18N3.C15H12F3N5.C12H7F2N4.C12H9N4.4Ir/c1-30(2,3)28-24(20-14-9-7-10-15-20)26(33-35-28)22-18-13-19-23(32-22)27-25(21-16-11-8-12-17-21)29(36-34-27)31(4,5)6;2*1-22(2,18-12-7-5-8-13-18)20-16-11-17-21(24-20)23(3,4)19-14-9-6-10-15-19;1-21(2,19-12-5-7-14-23-19)17-10-9-11-18(16-17)22(3,4)20-13-6-8-15-24-20;1-3-13-14(4-2)18(16-10-6-8-12-20-16)21-17(13)15-9-5-7-11-19-15;1-7-9(3)20-21-12(7)10-5-4-6-11(19-10)13-8(2)14(23-22-13)15(16,17)18;13-9-7-10(14)12(18-6-2-4-16-18)8-11(9)17-5-1-3-15-17;1-4-11(15-8-2-6-13-15)10-12(5-1)16-9-3-7-14-16;;;;/h7-19H,1-6H3;2*5-12,14,16-17H,1-4H3;5-15H,1-4H3;5-12H,3-4H2,1-2H3;4-6H,1-3H3;1-7H;1-9H;;;;/q3*-2;2*-1;-2;2*-1;4*+3.

What are the key properties of 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine?

2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine has a molecular weight of 3234.92 g/mol, XLogP of 33.59, 26 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2,6-bis(3-tert-butyl-4-phenylpyrazol-1-id-5-yl)pyridine;bis(2,6-bis(2-phenylpropan-2-yl)pyridine);2-(3,4-diethyl-5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine;1-(2,4-difluoro-5-pyrazol-1-ylbenzene-6-id-1-yl)pyrazole;2-(4,5-dimethylpyrazol-2-id-3-yl)-6-[4-methyl-3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(iridium(3+));1-(3-pyrazol-1-ylbenzene-2-id-1-yl)pyrazole;2-[2-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]propan-2-yl]pyridine is sourced from PubChem (CID 159149770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).