4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane

C172H159Ir4N9O4Si4-8 — CID 163647610

IUPAC4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane
SMILESCC(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)c1cccc2c1oc1c[c-]c(-c3cc(Cc4ccccc4)ccn3)cc12.C[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.Cc1c[c-]c(-c2cc(C(C)C)c([Si](C)(C)C)cn2)cc1.Cc1c[c-]c(-c2ccc([Si](C)(C)C)cn2)cc1.Cc1cc(C)c2oc3c[c-]c(-c4cc(Cc5ccccc5)ccn4)cc3c2c1.Cc1ccc(Cc2ccnc(-c3[c-]cc4oc5cccc(C#N)c5c4c3)c2)cc1.[Ir].[Ir].[Ir].[Ir].[c-]1cc2oc3ccc4ccccc4c3c2cc1-c1cc(Cc2ccccc2)ccn1
InChIInChI=1S/C28H18NO.C27H22NO.C26H17N2O.C26H20NO.2C18H24NSi.C15H18NSi.C14H16NSi.4Ir/c1-2-6-19(7-3-1)16-20-14-15-29-25(17-20)22-11-12-26-24(18-22)28-23-9-5-4-8-21(23)10-13-27(28)30-26;1-18(2)22-9-6-10-23-24-17-21(11-12-26(24)29-27(22)23)25-16-20(13-14-28-25)15-19-7-4-3-5-8-19;1-17-5-7-18(8-6-17)13-19-11-12-28-23(14-19)20-9-10-24-22(15-20)26-21(16-27)3-2-4-25(26)29-24;1-17-12-18(2)26-23(13-17)22-16-21(8-9-25(22)28-26)24-15-20(10-11-27-24)14-19-6-4-3-5-7-19;1-13(2)16-11-17(15-9-7-14(3)8-10-15)19-12-18(16)20(4,5)6;1-14(2)11-16-12-17(15-9-7-6-8-10-15)19-13-18(16)20(3,4)5;1-12-5-7-13(8-6-12)15-10-9-14(11-16-15)17(2,3)4;1-16(2,3)13-9-10-14(15-11-13)12-7-5-4-6-8-12;;;;/h1-10,12-15,17-18H,16H2;3-10,12-14,16-18H,15H2,1-2H3;2-8,10-12,14-15H,13H2,1H3;3-7,9-13,15-16H,14H2,1-2H3;7-9,11-13H,1-6H3;6-9,12-14H,11H2,1-5H3;5-7,9-11H,1-4H3;4-7,9-11H,1-3H3;;;;/q8*-1;;;;
InChIKeyCQKITDBPCYFOBA-UHFFFAOYSA-N
MW3297.43 g/mol
LogP42.53
Rot. Bonds24

About 4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane

4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane (PubChem CID 163647610) has the molecular formula C172H159Ir4N9O4Si4-8 and a molecular weight of 3297.43 g/mol. Its IUPAC name is 4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane.

Molecular Properties

Compound Name4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane
PubChem CID163647610
Molecular FormulaC172H159Ir4N9O4Si4-8
Molecular Weight3297.43 g/mol
Exact Mass3298.02
IUPAC Name4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane
SMILESCC(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)c1cccc2c1oc1c[c-]c(-c3cc(Cc4ccccc4)ccn3)cc12.C[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.Cc1c[c-]c(-c2cc(C(C)C)c([Si](C)(C)C)cn2)cc1.Cc1c[c-]c(-c2ccc([Si](C)(C)C)cn2)cc1.Cc1cc(C)c2oc3c[c-]c(-c4cc(Cc5ccccc5)ccn4)cc3c2c1.Cc1ccc(Cc2ccnc(-c3[c-]cc4oc5cccc(C#N)c5c4c3)c2)cc1.[Ir].[Ir].[Ir].[Ir].[c-]1cc2oc3ccc4ccccc4c3c2cc1-c1cc(Cc2ccccc2)ccn1
InChIInChI=1S/C28H18NO.C27H22NO.C26H17N2O.C26H20NO.2C18H24NSi.C15H18NSi.C14H16NSi.4Ir/c1-2-6-19(7-3-1)16-20-14-15-29-25(17-20)22-11-12-26-24(18-22)28-23-9-5-4-8-21(23)10-13-27(28)30-26;1-18(2)22-9-6-10-23-24-17-21(11-12-26(24)29-27(22)23)25-16-20(13-14-28-25)15-19-7-4-3-5-8-19;1-17-5-7-18(8-6-17)13-19-11-12-28-23(14-19)20-9-10-24-22(15-20)26-21(16-27)3-2-4-25(26)29-24;1-17-12-18(2)26-23(13-17)22-16-21(8-9-25(22)28-26)24-15-20(10-11-27-24)14-19-6-4-3-5-7-19;1-13(2)16-11-17(15-9-7-14(3)8-10-15)19-12-18(16)20(4,5)6;1-14(2)11-16-12-17(15-9-7-6-8-10-15)19-13-18(16)20(3,4)5;1-12-5-7-13(8-6-12)15-10-9-14(11-16-15)17(2,3)4;1-16(2,3)13-9-10-14(15-11-13)12-7-5-4-6-8-12;;;;/h1-10,12-15,17-18H,16H2;3-10,12-14,16-18H,15H2,1-2H3;2-8,10-12,14-15H,13H2,1H3;3-7,9-13,15-16H,14H2,1-2H3;7-9,11-13H,1-6H3;6-9,12-14H,11H2,1-5H3;5-7,9-11H,1-4H3;4-7,9-11H,1-3H3;;;;/q8*-1;;;;
InChIKeyCQKITDBPCYFOBA-UHFFFAOYSA-N
XLogP42.53
TPSA179.47 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds24
Heavy Atoms193
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003297.43
LogP ≤ 542.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

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

Analyze 4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane?
The IUPAC name of 4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane (CID 163647610) is 4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane.
What is the SMILES notation for 4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane?
The canonical SMILES for 4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane is CC(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)c1cccc2c1oc1c[c-]c(-c3cc(Cc4ccccc4)ccn3)cc12.C[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.Cc1c[c-]c(-c2cc(C(C)C)c([Si](C)(C)C)cn2)cc1.Cc1c[c-]c(-c2ccc([Si](C)(C)C)cn2)cc1.Cc1cc(C)c2oc3c[c-]c(-c4cc(Cc5ccccc5)ccn4)cc3c2c1.Cc1ccc(Cc2ccnc(-c3[c-]cc4oc5cccc(C#N)c5c4c3)c2)cc1.[Ir].[Ir].[Ir].[Ir].[c-]1cc2oc3ccc4ccccc4c3c2cc1-c1cc(Cc2ccccc2)ccn1.
What is the InChIKey of 4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane?
The InChIKey is CQKITDBPCYFOBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H18NO.C27H22NO.C26H17N2O.C26H20NO.2C18H24NSi.C15H18NSi.C14H16NSi.4Ir/c1-2-6-19(7-3-1)16-20-14-15-29-25(17-20)22-11-12-26-24(18-22)28-23-9-5-4-8-21(23)10-13-27(28)30-26;1-18(2)22-9-6-10-23-24-17-21(11-12-26(24)29-27(22)23)25-16-20(13-14-28-25)15-19-7-4-3-5-8-19;1-17-5-7-18(8-6-17)13-19-11-12-28-23(14-19)20-9-10-24-22(15-20)26-21(16-27)3-2-4-25(26)29-24;1-17-12-18(2)26-23(13-17)22-16-21(8-9-25(22)28-26)24-15-20(10-11-27-24)14-19-6-4-3-5-7-19;1-13(2)16-11-17(15-9-7-14(3)8-10-15)19-12-18(16)20(4,5)6;1-14(2)11-16-12-17(15-9-7-6-8-10-15)19-13-18(16)20(3,4)5;1-12-5-7-13(8-6-12)15-10-9-14(11-16-15)17(2,3)4;1-16(2,3)13-9-10-14(15-11-13)12-7-5-4-6-8-12;;;;/h1-10,12-15,17-18H,16H2;3-10,12-14,16-18H,15H2,1-2H3;2-8,10-12,14-15H,13H2,1H3;3-7,9-13,15-16H,14H2,1-2H3;7-9,11-13H,1-6H3;6-9,12-14H,11H2,1-5H3;5-7,9-11H,1-4H3;4-7,9-11H,1-3H3;;;;/q8*-1;;;;.
What are the key properties of 4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane?
4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane has a molecular weight of 3297.43 g/mol, XLogP of 42.53, 24 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-2-(6,8-dimethyl-3H-dibenzofuran-3-id-2-yl)pyridine;4-benzyl-2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)pyridine;4-benzyl-2-(6-propan-2-yl-3H-dibenzofuran-3-id-2-yl)pyridine;tetrakis(iridium);8-[4-[(4-methylphenyl)methyl]-2-pyridinyl]-7H-dibenzofuran-7-ide-1-carbonitrile;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-(6-phenyl-3-pyridinyl)silane is sourced from PubChem (CID 163647610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).