3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine

C192H203Ir4N12O2-3 — CID 158045408

About 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine

3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine (PubChem CID 158045408) has the molecular formula C192H203Ir4N12O2-3 and a molecular weight of 3479.69 g/mol. Its IUPAC name is 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine.

Molecular Properties

• Compound Name: 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine
• PubChem CID: 158045408
• Molecular Formula: C192H203Ir4N12O2-3
• Molecular Weight: 3479.69 g/mol
• Exact Mass: 3480.47
• IUPAC Name: 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine
• SMILES: CC(C)c1cccc(C(C)C)c1-n1c(-c2[c-]cccc2)nc2ccccc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2[c-]cccc2)nc2ccccc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2[c-]cccc2)nc2ccccc21.CCC(CC)C(=O)CC(O)C(CC)CC.CN1[CH-]N(c2[c-]cccc2)c2cc(C3CCC(c4ccccc4)CC3)ccc21.CN1[CH-]N(c2[c-]cccc2)c2ccc(C3CCC(c4ccccc4)CC3)cc21.Cc1[c-]c(-c2cc(C3CCC(c4ccccc4)CC3)c3ccccc3n2)cc(C)c1.[Ir+3].[Ir+3].[Ir].[Ir].[c-]1ccccc1-c1cc(C2CCC(c3ccccc3)CC2)ccn1
• InChI: InChI=1S/C29H28N.2C26H26N2.3C25H25N2.C23H22N.C13H26O2.4Ir/c1-20-16-21(2)18-25(17-20)29-19-27(26-10-6-7-11-28(26)30-29)24-14-12-23(13-15-24)22-8-4-3-5-9-22;1-27-19-28(24-10-6-3-7-11-24)25-17-16-23(18-26(25)27)22-14-12-21(13-15-22)20-8-4-2-5-9-20;1-27-19-28(24-10-6-3-7-11-24)26-18-23(16-17-25(26)27)22-14-12-21(13-15-22)20-8-4-2-5-9-20;3*1-17(2)20-13-10-14-21(18(3)4)24(20)27-23-16-9-8-15-22(23)26-25(27)19-11-6-5-7-12-19;1-3-7-18(8-4-1)19-11-13-20(14-12-19)22-15-16-24-23(17-22)21-9-5-2-6-10-21;1-5-10(6-2)12(14)9-13(15)11(7-3)8-4;;;;/h3-11,16-17,19,23-24H,12-15H2,1-2H3;2*2-10,16-19,21-22H,12-15H2,1H3;3*5-11,13-18H,1-4H3;1-9,15-17,19-20H,11-14H2;10-12,14H,5-9H2,1-4H3;;;;/q-1;2*-2;4*-1;;;;2*+3
• InChIKey: VISYUQZSIRYWQT-UHFFFAOYSA-N
• XLogP: 50.41
• TPSA: 129.50 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 32
• Heavy Atoms: 210
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3479.69
LogP ≤ 5	50.41
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine?

The IUPAC name of 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine (CID 158045408) is 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine.

What is the SMILES notation for 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine?

The canonical SMILES for 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine is CC(C)c1cccc(C(C)C)c1-n1c(-c2[c-]cccc2)nc2ccccc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2[c-]cccc2)nc2ccccc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2[c-]cccc2)nc2ccccc21.CCC(CC)C(=O)CC(O)C(CC)CC.CN1[CH-]N(c2[c-]cccc2)c2cc(C3CCC(c4ccccc4)CC3)ccc21.CN1[CH-]N(c2[c-]cccc2)c2ccc(C3CCC(c4ccccc4)CC3)cc21.Cc1[c-]c(-c2cc(C3CCC(c4ccccc4)CC3)c3ccccc3n2)cc(C)c1.[Ir+3].[Ir+3].[Ir].[Ir].[c-]1ccccc1-c1cc(C2CCC(c3ccccc3)CC2)ccn1.

What is the InChIKey of 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine?

The InChIKey is VISYUQZSIRYWQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H28N.2C26H26N2.3C25H25N2.C23H22N.C13H26O2.4Ir/c1-20-16-21(2)18-25(17-20)29-19-27(26-10-6-7-11-28(26)30-29)24-14-12-23(13-15-24)22-8-4-3-5-9-22;1-27-19-28(24-10-6-3-7-11-24)25-17-16-23(18-26(25)27)22-14-12-21(13-15-22)20-8-4-2-5-9-20;1-27-19-28(24-10-6-3-7-11-24)26-18-23(16-17-25(26)27)22-14-12-21(13-15-22)20-8-4-2-5-9-20;3*1-17(2)20-13-10-14-21(18(3)4)24(20)27-23-16-9-8-15-22(23)26-25(27)19-11-6-5-7-12-19;1-3-7-18(8-4-1)19-11-13-20(14-12-19)22-15-16-24-23(17-22)21-9-5-2-6-10-21;1-5-10(6-2)12(14)9-13(15)11(7-3)8-4;;;;/h3-11,16-17,19,23-24H,12-15H2,1-2H3;2*2-10,16-19,21-22H,12-15H2,1H3;3*5-11,13-18H,1-4H3;1-9,15-17,19-20H,11-14H2;10-12,14H,5-9H2,1-4H3;;;;/q-1;2*-2;4*-1;;;;2*+3.

What are the key properties of 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine?

3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine has a molecular weight of 3479.69 g/mol, XLogP of 50.41, 32 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 3,7-diethyl-6-hydroxynonan-4-one;2-(3,5-dimethylbenzene-6-id-1-yl)-4-(4-phenylcyclohexyl)quinoline;tris(1-[2,6-di(propan-2-yl)phenyl]-2-phenylbenzimidazole);bis(iridium);bis(iridium(3+));1-methyl-3-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;3-methyl-1-phenyl-5-(4-phenylcyclohexyl)-2H-benzimidazol-2-ide;2-phenyl-4-(4-phenylcyclohexyl)pyridine is sourced from PubChem (CID 158045408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).