bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine)

C161H140Ir5N17 — CID 161480138

About bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine)

bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine) (PubChem CID 161480138) has the molecular formula C161H140Ir5N17 and a molecular weight of 3274.09 g/mol. Its IUPAC name is bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine).

Molecular Properties

• Compound Name: bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine)
• PubChem CID: 161480138
• Molecular Formula: C161H140Ir5N17
• Molecular Weight: 3274.09 g/mol
• Exact Mass: 3275.96
• IUPAC Name: bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine)
• SMILES: C.CC(C)(c1[c-]cccc1)c1ccccn1.CC(C)(c1[c-]cccc1)c1ccccn1.CC(C)(c1[c-]cccc1)c1ccccn1.CN1C=CN(c2[c-]cccc2)[CH-]1.CN1[CH-]N(c2[c-]cccc2)c2cccnc21.CN1[CH-]N(c2[c-]cccc2)c2ncccc21.[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].[c-]1ccccc1C(c1ccccc1)(c1ccccc1)c1ccccn1.[c-]1ccccc1C(c1ccccc1)(c1ccccc1)c1ccccn1.[c-]1ccccc1N1C=CN(c2ccccc2)[CH-]1.[c-]1ccccc1N1[CH-]N(c2ccccc2)c2ccccc21
• InChI: InChI=1S/2C24H18N.C19H14N2.C15H12N2.3C14H14N.2C13H11N3.C10H10N2.CH4.5Ir/c2*1-4-12-20(13-5-1)24(21-14-6-2-7-15-21,22-16-8-3-9-17-22)23-18-10-11-19-25-23;1-3-9-16(10-4-1)20-15-21(17-11-5-2-6-12-17)19-14-8-7-13-18(19)20;1-3-7-14(8-4-1)16-11-12-17(13-16)15-9-5-2-6-10-15;3*1-14(2,12-8-4-3-5-9-12)13-10-6-7-11-15-13;1-15-10-16(11-6-3-2-4-7-11)12-8-5-9-14-13(12)15;1-15-10-16(11-6-3-2-4-7-11)13-12(15)8-5-9-14-13;1-11-7-8-12(9-11)10-5-3-2-4-6-10;;;;;;/h2*1-16,18-19H;1-11,13-15H;1-9,11-13H;3*3-8,10-11H,1-2H3;2*2-6,8-10H,1H3;2-5,7-9H,1H3;1H4;;;;;/q2*-1;2*-2;3*-1;3*-2;;5*+3
• InChIKey: FBQKYOHRJXGHKK-UHFFFAOYSA-N
• XLogP: 36.08
• TPSA: 122.63 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 21
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3274.09
LogP ≤ 5	36.08
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine)?

The IUPAC name of bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine) (CID 161480138) is bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine).

What is the SMILES notation for bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine)?

The canonical SMILES for bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine) is C.CC(C)(c1[c-]cccc1)c1ccccn1.CC(C)(c1[c-]cccc1)c1ccccn1.CC(C)(c1[c-]cccc1)c1ccccn1.CN1C=CN(c2[c-]cccc2)[CH-]1.CN1[CH-]N(c2[c-]cccc2)c2cccnc21.CN1[CH-]N(c2[c-]cccc2)c2ncccc21.[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].[c-]1ccccc1C(c1ccccc1)(c1ccccc1)c1ccccn1.[c-]1ccccc1C(c1ccccc1)(c1ccccc1)c1ccccn1.[c-]1ccccc1N1C=CN(c2ccccc2)[CH-]1.[c-]1ccccc1N1[CH-]N(c2ccccc2)c2ccccc21.

What is the InChIKey of bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine)?

The InChIKey is FBQKYOHRJXGHKK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C24H18N.C19H14N2.C15H12N2.3C14H14N.2C13H11N3.C10H10N2.CH4.5Ir/c2*1-4-12-20(13-5-1)24(21-14-6-2-7-15-21,22-16-8-3-9-17-22)23-18-10-11-19-25-23;1-3-9-16(10-4-1)20-15-21(17-11-5-2-6-12-17)19-14-8-7-13-18(19)20;1-3-7-14(8-4-1)16-11-12-17(13-16)15-9-5-2-6-10-15;3*1-14(2,12-8-4-3-5-9-12)13-10-6-7-11-15-13;1-15-10-16(11-6-3-2-4-7-11)12-8-5-9-14-13(12)15;1-15-10-16(11-6-3-2-4-7-11)13-12(15)8-5-9-14-13;1-11-7-8-12(9-11)10-5-3-2-4-6-10;;;;;;/h2*1-16,18-19H;1-11,13-15H;1-9,11-13H;3*3-8,10-11H,1-2H3;2*2-6,8-10H,1H3;2-5,7-9H,1H3;1H4;;;;;/q2*-1;2*-2;3*-1;3*-2;;5*+3.

What are the key properties of bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine)?

bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine) has a molecular weight of 3274.09 g/mol, XLogP of 36.08, 21 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-[diphenyl(phenyl)methyl]pyridine);pentakis(iridium(3+));methane;1-methyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;3-methyl-1-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-methyl-3-phenyl-2H-imidazol-2-ide;1-phenyl-3-phenyl-2H-benzimidazol-2-ide;1-phenyl-3-phenyl-2H-imidazol-2-ide;tris(2-(2-phenylpropan-2-yl)pyridine) is sourced from PubChem (CID 161480138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).