2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole

C192H187FIr6N22-4 — CID 159473469

About 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole

2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole (PubChem CID 159473469) has the molecular formula C192H187FIr6N22-4 and a molecular weight of 3975.06 g/mol. Its IUPAC name is 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole.

Molecular Properties

• Compound Name: 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole
• PubChem CID: 159473469
• Molecular Formula: C192H187FIr6N22-4
• Molecular Weight: 3975.06 g/mol
• Exact Mass: 3977.31
• IUPAC Name: 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole
• SMILES: CC(C)c1cc(-n2c3ccccc3c3ccccc32)cc(C(C)C)c1-n1ccnc1-c1[c-]cc(F)cc1.CC(C)c1cc(-n2c3ccccc3c3ccccc32)cc(C(C)C)c1-n1ccnc1-c1[c-]cccc1.CN1[CH-]N(c2[c-]cccc2)c2ccccc21.CN1[CH-]N(c2[c-]cccc2)c2ccccc21.Cc1c[c-]c(-c2nccn2-c2c(C(C)C)cc(-c3cncnc3)cc2C(C)C)cc1.Cc1cc(-c2cc(C(C)C)c(-n3ccnc3-c3[c-]cccc3)c(C(C)C)c2)cc(C)n1.Cc1cc(C(C)C)c(-n2ccnc2-c2[c-]cccc2)c(C(C)C)c1.[C-]#[N+]c1cc(C(C)C)c(-n2ccnc2-c2[c-]cccc2)c(C(C)C)c1.[Ir+3].[Ir+3].[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/C33H29FN3.C33H30N3.C28H30N3.C26H27N4.C22H22N3.C22H25N2.2C14H12N2.6Ir/c1-21(2)28-19-25(37-30-11-7-5-9-26(30)27-10-6-8-12-31(27)37)20-29(22(3)4)32(28)36-18-17-35-33(36)23-13-15-24(34)16-14-23;1-22(2)28-20-25(36-30-16-10-8-14-26(30)27-15-9-11-17-31(27)36)21-29(23(3)4)32(28)35-19-18-34-33(35)24-12-6-5-7-13-24;1-18(2)25-16-24(23-14-20(5)30-21(6)15-23)17-26(19(3)4)27(25)31-13-12-29-28(31)22-10-8-7-9-11-22;1-17(2)23-12-21(22-14-27-16-28-15-22)13-24(18(3)4)25(23)30-11-10-29-26(30)20-8-6-19(5)7-9-20;1-15(2)19-13-18(23-5)14-20(16(3)4)21(19)25-12-11-24-22(25)17-9-7-6-8-10-17;1-15(2)19-13-17(5)14-20(16(3)4)21(19)24-12-11-23-22(24)18-9-7-6-8-10-18;2*1-15-11-16(12-7-3-2-4-8-12)14-10-6-5-9-13(14)15;;;;;;/h5-13,15-22H,1-4H3;5-12,14-23H,1-4H3;7-10,12-19H,1-6H3;6-8,10-18H,1-5H3;6-9,11-16H,1-4H3;6-9,11-16H,1-5H3;2*2-7,9-11H,1H3;;;;;;/q6*-1;2*-2;;;;;2*+3
• InChIKey: FEGIPGSBUVXYLE-UHFFFAOYSA-N
• XLogP: 49.53
• TPSA: 172.77 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 30
• Heavy Atoms: 221
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3975.06
LogP ≤ 5	49.53
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole?

The IUPAC name of 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole (CID 159473469) is 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole.

What is the SMILES notation for 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole?

The canonical SMILES for 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole is CC(C)c1cc(-n2c3ccccc3c3ccccc32)cc(C(C)C)c1-n1ccnc1-c1[c-]cc(F)cc1.CC(C)c1cc(-n2c3ccccc3c3ccccc32)cc(C(C)C)c1-n1ccnc1-c1[c-]cccc1.CN1[CH-]N(c2[c-]cccc2)c2ccccc21.CN1[CH-]N(c2[c-]cccc2)c2ccccc21.Cc1c[c-]c(-c2nccn2-c2c(C(C)C)cc(-c3cncnc3)cc2C(C)C)cc1.Cc1cc(-c2cc(C(C)C)c(-n3ccnc3-c3[c-]cccc3)c(C(C)C)c2)cc(C)n1.Cc1cc(C(C)C)c(-n2ccnc2-c2[c-]cccc2)c(C(C)C)c1.[C-]#[N+]c1cc(C(C)C)c(-n2ccnc2-c2[c-]cccc2)c(C(C)C)c1.[Ir+3].[Ir+3].[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole?

The InChIKey is FEGIPGSBUVXYLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H29FN3.C33H30N3.C28H30N3.C26H27N4.C22H22N3.C22H25N2.2C14H12N2.6Ir/c1-21(2)28-19-25(37-30-11-7-5-9-26(30)27-10-6-8-12-31(27)37)20-29(22(3)4)32(28)36-18-17-35-33(36)23-13-15-24(34)16-14-23;1-22(2)28-20-25(36-30-16-10-8-14-26(30)27-15-9-11-17-31(27)36)21-29(23(3)4)32(28)35-19-18-34-33(35)24-12-6-5-7-13-24;1-18(2)25-16-24(23-14-20(5)30-21(6)15-23)17-26(19(3)4)27(25)31-13-12-29-28(31)22-10-8-7-9-11-22;1-17(2)23-12-21(22-14-27-16-28-15-22)13-24(18(3)4)25(23)30-11-10-29-26(30)20-8-6-19(5)7-9-20;1-15(2)19-13-18(23-5)14-20(16(3)4)21(19)25-12-11-24-22(25)17-9-7-6-8-10-17;1-15(2)19-13-17(5)14-20(16(3)4)21(19)24-12-11-23-22(24)18-9-7-6-8-10-18;2*1-15-11-16(12-7-3-2-4-8-12)14-10-6-5-9-13(14)15;;;;;;/h5-13,15-22H,1-4H3;5-12,14-23H,1-4H3;7-10,12-19H,1-6H3;6-8,10-18H,1-5H3;6-9,11-16H,1-4H3;6-9,11-16H,1-5H3;2*2-7,9-11H,1H3;;;;;;/q6*-1;2*-2;;;;;2*+3.

What are the key properties of 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole?

2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole has a molecular weight of 3975.06 g/mol, XLogP of 49.53, 30 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 2,6-dimethyl-4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]pyridine;9-[4-[2-(4-fluorobenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]carbazole;tetrakis(iridium);bis(iridium(3+));1-[4-isocyano-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;5-[4-[2-(4-methylbenzene-6-id-1-yl)imidazol-1-yl]-3,5-di(propan-2-yl)phenyl]pyrimidine;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;bis(1-methyl-3-phenyl-2H-benzimidazol-2-ide);9-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]carbazole is sourced from PubChem (CID 159473469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).