4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane

C190H170F3Ir4N9O4Si4-8 — CID 163917224

About 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane

4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane (PubChem CID 163917224) has the molecular formula C190H170F3Ir4N9O4Si4-8 and a molecular weight of 3589.76 g/mol. Its IUPAC name is 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane.

Molecular Properties

• Compound Name: 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane
• PubChem CID: 163917224
• Molecular Formula: C190H170F3Ir4N9O4Si4-8
• Molecular Weight: 3589.76 g/mol
• Exact Mass: 3590.15
• IUPAC Name: 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane
• SMILES: C[Si](C)(C)c1ccc(-c2[c-]cc(F)cc2)nc1.Cc1cc[c-]c(-c2cc(CC(C)(C)C)c([Si](C)(C)C)cn2)c1F.[2H]C(C)(C)c1cc(-c2[c-]ccc(-c3ccccc3)c2)ncc1[Si](C)(C)C.[2H]C(C)(c1ccccc1)c1ccnc(-c2[c-]cc(C#N)c3c2oc2ccccc23)c1.[2H]C(C)(c1ccccc1)c1ccnc(-c2[c-]ccc3c2oc2c4ccccc4ccc32)c1.[2H]C(C)(c1ccccc1)c1ccnc(-c2[c-]ccc3c2oc2ccc(C(C)(C)F)cc23)c1.[2H]C(C)(c1ccccc1)c1ccnc(-c2[c-]ccc3c2oc2ccc4ccccc4c23)c1.[2H]C([2H])([2H])c1c[c-]c(-c2cc(-c3ccccc3)c([Si](C)(C)C)cn2)cc1.[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/2C29H20NO.C28H23FNO.C26H17N2O.C23H26NSi.C21H22NSi.C20H27FNSi.C14H15FNSi.4Ir/c1-19(20-8-3-2-4-9-20)22-16-17-30-27(18-22)26-13-7-12-24-25-15-14-21-10-5-6-11-23(21)28(25)31-29(24)26;1-19(20-8-3-2-4-9-20)22-16-17-30-26(18-22)24-12-7-13-25-28-23-11-6-5-10-21(23)14-15-27(28)31-29(24)25;1-18(19-8-5-4-6-9-19)20-14-15-30-25(16-20)23-11-7-10-22-24-17-21(28(2,3)29)12-13-26(24)31-27(22)23;1-17(18-7-3-2-4-8-18)19-13-14-28-23(15-19)21-12-11-20(16-27)25-22-9-5-6-10-24(22)29-26(21)25;1-17(2)21-15-22(24-16-23(21)25(3,4)5)20-13-9-12-19(14-20)18-10-7-6-8-11-18;1-16-10-12-18(13-11-16)20-14-19(17-8-6-5-7-9-17)21(15-22-20)23(2,3)4;1-14-9-8-10-16(19(14)21)17-11-15(12-20(2,3)4)18(13-22-17)23(5,6)7;1-17(2,3)13-8-9-14(16-10-13)11-4-6-12(15)7-5-11;;;;/h2-12,14-19H,1H3;2-11,13-19H,1H3;4-10,12-18H,1-3H3;2-11,13-15,17H,1H3;6-12,14-17H,1-5H3;5-12,14-15H,1-4H3;8-9,11,13H,12H2,1-7H3;4,6-10H,1-3H3;;;;/q8*-1;;;;/i2*19D;18D;2*17D;1D3
• InChIKey: YTZURYAWTMWMIA-UWXNXQAESA-N
• XLogP: 49.09
• TPSA: 179.47 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 26
• Heavy Atoms: 214
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3589.76
LogP ≤ 5	49.09
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane?

The IUPAC name of 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane (CID 163917224) is 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane.

What is the SMILES notation for 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane?

The canonical SMILES for 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane is C[Si](C)(C)c1ccc(-c2[c-]cc(F)cc2)nc1.Cc1cc[c-]c(-c2cc(CC(C)(C)C)c([Si](C)(C)C)cn2)c1F.[2H]C(C)(C)c1cc(-c2[c-]ccc(-c3ccccc3)c2)ncc1[Si](C)(C)C.[2H]C(C)(c1ccccc1)c1ccnc(-c2[c-]cc(C#N)c3c2oc2ccccc23)c1.[2H]C(C)(c1ccccc1)c1ccnc(-c2[c-]ccc3c2oc2c4ccccc4ccc32)c1.[2H]C(C)(c1ccccc1)c1ccnc(-c2[c-]ccc3c2oc2ccc(C(C)(C)F)cc23)c1.[2H]C(C)(c1ccccc1)c1ccnc(-c2[c-]ccc3c2oc2ccc4ccccc4c23)c1.[2H]C([2H])([2H])c1c[c-]c(-c2cc(-c3ccccc3)c([Si](C)(C)C)cn2)cc1.[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane?

The InChIKey is YTZURYAWTMWMIA-UWXNXQAESA-N. The full InChI is InChI=1S/2C29H20NO.C28H23FNO.C26H17N2O.C23H26NSi.C21H22NSi.C20H27FNSi.C14H15FNSi.4Ir/c1-19(20-8-3-2-4-9-20)22-16-17-30-27(18-22)26-13-7-12-24-25-15-14-21-10-5-6-11-23(21)28(25)31-29(24)26;1-19(20-8-3-2-4-9-20)22-16-17-30-26(18-22)24-12-7-13-25-28-23-11-6-5-10-21(23)14-15-27(28)31-29(24)25;1-18(19-8-5-4-6-9-19)20-14-15-30-25(16-20)23-11-7-10-22-24-17-21(28(2,3)29)12-13-26(24)31-27(22)23;1-17(18-7-3-2-4-8-18)19-13-14-28-23(15-19)21-12-11-20(16-27)25-22-9-5-6-10-24(22)29-26(21)25;1-17(2)21-15-22(24-16-23(21)25(3,4)5)20-13-9-12-19(14-20)18-10-7-6-8-11-18;1-16-10-12-18(13-11-16)20-14-19(17-8-6-5-7-9-17)21(15-22-20)23(2,3)4;1-14-9-8-10-16(19(14)21)17-11-15(12-20(2,3)4)18(13-22-17)23(5,6)7;1-17(2,3)13-8-9-14(16-10-13)11-4-6-12(15)7-5-11;;;;/h2-12,14-19H,1H3;2-11,13-19H,1H3;4-10,12-18H,1-3H3;2-11,13-15,17H,1H3;6-12,14-17H,1-5H3;5-12,14-15H,1-4H3;8-9,11,13H,12H2,1-7H3;4,6-10H,1-3H3;;;;/q8*-1;;;;/i2*19D;18D;2*17D;1D3;;;;;;.

What are the key properties of 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane?

4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane has a molecular weight of 3589.76 g/mol, XLogP of 49.09, 26 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(1-deuterio-1-phenylethyl)-2-[8-(2-fluoropropan-2-yl)-3H-dibenzofuran-3-id-4-yl]pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[1,2-b][1]benzofuran-9-id-10-yl)pyridine;4-(1-deuterio-1-phenylethyl)-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-8-yl)pyridine;4-[4-(1-deuterio-1-phenylethyl)-2-pyridinyl]-3H-dibenzofuran-3-ide-1-carbonitrile;[4-(2-deuteriopropan-2-yl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(2,2-dimethylpropyl)-6-(2-fluoro-3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;tetrakis(iridium);trimethyl-[4-phenyl-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane is sourced from PubChem (CID 163917224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).