4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine

C146H124Ir3N6O2S-6 — CID 163655178

IUPAC4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine
SMILESCC(C)(c1ccccc1)c1ccnc(-c2[c-]cc3oc4c(-c5ccccc5)cccc4c3c2)c1.CC(C)(c1ccccc1)c1ccnc(-c2[c-]cc3oc4ccc5ccccc5c4c3c2)c1.CC(C)(c1ccccc1)c1ccnc(-c2[c-]cc3sc4c5ccccc5ccc4c3c2)c1.Cc1c[c-]c(-c2cc(C)c(CC(C)C)cn2)cc1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.[Ir].[Ir].[Ir]
InChIInChI=1S/C32H24NO.C30H22NO.C30H22NS.C19H22N.C18H14N.C17H20N.3Ir/c1-32(2,24-12-7-4-8-13-24)25-18-19-33-29(21-25)23-16-17-30-28(20-23)27-15-9-14-26(31(27)34-30)22-10-5-3-6-11-22;1-30(2,22-9-4-3-5-10-22)23-16-17-31-26(19-23)21-13-14-27-25(18-21)29-24-11-7-6-8-20(24)12-15-28(29)32-27;1-30(2,22-9-4-3-5-10-22)23-16-17-31-27(19-23)21-13-15-28-26(18-21)25-14-12-20-8-6-7-11-24(20)29(25)32-28;1-15-14-20-19(17-10-6-3-7-11-17)13-18(15)12-16-8-4-2-5-9-16;1-14-13-19-18(16-10-6-3-7-11-16)12-17(14)15-8-4-2-5-9-15;1-12(2)9-16-11-18-17(10-14(16)4)15-7-5-13(3)6-8-15;;;/h3-15,17-21H,1-2H3;2*3-12,14-19H,1-2H3;3,6-7,10,13-14,16H,2,4-5,8-9,12H2,1H3;2-10,12-13H,1H3;5-7,10-12H,9H2,1-4H3;;;/q6*-1;;;
InChIKeyHYJKUIXEWURQDG-UHFFFAOYSA-N
MW2603.36 g/mol
LogP38.63
Rot. Bonds18

About 4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine

4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine (PubChem CID 163655178) has the molecular formula C146H124Ir3N6O2S-6 and a molecular weight of 2603.36 g/mol. Its IUPAC name is 4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine.

Molecular Properties

Compound Name4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine
PubChem CID163655178
Molecular FormulaC146H124Ir3N6O2S-6
Molecular Weight2603.36 g/mol
Exact Mass2603.84
IUPAC Name4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine
SMILESCC(C)(c1ccccc1)c1ccnc(-c2[c-]cc3oc4c(-c5ccccc5)cccc4c3c2)c1.CC(C)(c1ccccc1)c1ccnc(-c2[c-]cc3oc4ccc5ccccc5c4c3c2)c1.CC(C)(c1ccccc1)c1ccnc(-c2[c-]cc3sc4c5ccccc5ccc4c3c2)c1.Cc1c[c-]c(-c2cc(C)c(CC(C)C)cn2)cc1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.[Ir].[Ir].[Ir]
InChIInChI=1S/C32H24NO.C30H22NO.C30H22NS.C19H22N.C18H14N.C17H20N.3Ir/c1-32(2,24-12-7-4-8-13-24)25-18-19-33-29(21-25)23-16-17-30-28(20-23)27-15-9-14-26(31(27)34-30)22-10-5-3-6-11-22;1-30(2,22-9-4-3-5-10-22)23-16-17-31-26(19-23)21-13-14-27-25(18-21)29-24-11-7-6-8-20(24)12-15-28(29)32-27;1-30(2,22-9-4-3-5-10-22)23-16-17-31-27(19-23)21-13-15-28-26(18-21)25-14-12-20-8-6-7-11-24(20)29(25)32-28;1-15-14-20-19(17-10-6-3-7-11-17)13-18(15)12-16-8-4-2-5-9-16;1-14-13-19-18(16-10-6-3-7-11-16)12-17(14)15-8-4-2-5-9-15;1-12(2)9-16-11-18-17(10-14(16)4)15-7-5-13(3)6-8-15;;;/h3-15,17-21H,1-2H3;2*3-12,14-19H,1-2H3;3,6-7,10,13-14,16H,2,4-5,8-9,12H2,1H3;2-10,12-13H,1H3;5-7,10-12H,9H2,1-4H3;;;/q6*-1;;;
InChIKeyHYJKUIXEWURQDG-UHFFFAOYSA-N
XLogP38.63
TPSA103.62 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds18
Heavy Atoms158
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002603.36
LogP ≤ 538.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze 4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine?
The IUPAC name of 4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine (CID 163655178) is 4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine.
What is the SMILES notation for 4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine?
The canonical SMILES for 4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine is CC(C)(c1ccccc1)c1ccnc(-c2[c-]cc3oc4c(-c5ccccc5)cccc4c3c2)c1.CC(C)(c1ccccc1)c1ccnc(-c2[c-]cc3oc4ccc5ccccc5c4c3c2)c1.CC(C)(c1ccccc1)c1ccnc(-c2[c-]cc3sc4c5ccccc5ccc4c3c2)c1.Cc1c[c-]c(-c2cc(C)c(CC(C)C)cn2)cc1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.[Ir].[Ir].[Ir].
What is the InChIKey of 4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine?
The InChIKey is HYJKUIXEWURQDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24NO.C30H22NO.C30H22NS.C19H22N.C18H14N.C17H20N.3Ir/c1-32(2,24-12-7-4-8-13-24)25-18-19-33-29(21-25)23-16-17-30-28(20-23)27-15-9-14-26(31(27)34-30)22-10-5-3-6-11-22;1-30(2,22-9-4-3-5-10-22)23-16-17-31-26(19-23)21-13-14-27-25(18-21)29-24-11-7-6-8-20(24)12-15-28(29)32-27;1-30(2,22-9-4-3-5-10-22)23-16-17-31-27(19-23)21-13-15-28-26(18-21)25-14-12-20-8-6-7-11-24(20)29(25)32-28;1-15-14-20-19(17-10-6-3-7-11-17)13-18(15)12-16-8-4-2-5-9-16;1-14-13-19-18(16-10-6-3-7-11-16)12-17(14)15-8-4-2-5-9-15;1-12(2)9-16-11-18-17(10-14(16)4)15-7-5-13(3)6-8-15;;;/h3-15,17-21H,1-2H3;2*3-12,14-19H,1-2H3;3,6-7,10,13-14,16H,2,4-5,8-9,12H2,1H3;2-10,12-13H,1H3;5-7,10-12H,9H2,1-4H3;;;/q6*-1;;;.
What are the key properties of 4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine?
4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine has a molecular weight of 2603.36 g/mol, XLogP of 38.63, 18 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine is sourced from PubChem (CID 163655178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).