2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid

C122H107F18Ir2N10O6OsP2Pt+ — CID 161160841

IUPAC2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid
SMILESC(=C[PH+](c1ccccc1)c1ccccc1)[PH+](c1ccccc1)c1ccccc1.CCc1c(CC)c2cc3c(CC)c(CC)c4cc5c(CC)c(CC)c6cc7c(CC)c(CC)c(cc1n2[n+]65)n7[n+]34.Cc1cc(C)nc(-c2ccccn2)c1.Fc1c[c-]c(-c2ccc(C(F)(F)F)cn2)cc1.O=C(O)c1ccccn1.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.[Ir].[Ir].[Os].[Pt].c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1
InChIInChI=1S/C36H44N4.C26H22P2.C22H16N2.C12H6F4N.C12H12N2.C6H5NO2.2C4HF7O2.2Ir.Os.Pt/c1-9-21-22(10-2)30-18-32-25(13-5)28(16-8)36-20-34-27(15-7)26(14-6)33-19-35-24(12-4)23(11-3)31(39(35)40(32)36)17-29(21)37(30)38(33)34;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-7-17(8-4-1)19-11-13-23-21(15-19)22-16-20(12-14-24-22)18-9-5-2-6-10-18;13-10-4-1-8(2-5-10)11-6-3-9(7-17-11)12(14,15)16;1-9-7-10(2)14-12(8-9)11-5-3-4-6-13-11;8-6(9)5-3-1-2-4-7-5;2*5-2(6,1(12)13)3(7,8)4(9,10)11;;;;/h17-20H,9-16H2,1-8H3;1-22H;1-16H;1,3-7H;3-8H,1-2H3;1-4H,(H,8,9);2*(H,12,13);;;;/q+2;;;-1;;;;;;;;/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20+;;;;;;;;;;;
InChIKeyGGRFNEVPTHLBFZ-IUXFOZNNSA-N
MW2982.92 g/mol
LogP26.39
Rot. Bonds24

About 2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid

2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid (PubChem CID 161160841) has the molecular formula C122H107F18Ir2N10O6OsP2Pt+ and a molecular weight of 2982.92 g/mol. Its IUPAC name is 2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid.

Molecular Properties

Compound Name2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid
PubChem CID161160841
Molecular FormulaC122H107F18Ir2N10O6OsP2Pt+
Molecular Weight2982.92 g/mol
Exact Mass2984.61
IUPAC Name2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid
SMILESC(=C[PH+](c1ccccc1)c1ccccc1)[PH+](c1ccccc1)c1ccccc1.CCc1c(CC)c2cc3c(CC)c(CC)c4cc5c(CC)c(CC)c6cc7c(CC)c(CC)c(cc1n2[n+]65)n7[n+]34.Cc1cc(C)nc(-c2ccccn2)c1.Fc1c[c-]c(-c2ccc(C(F)(F)F)cn2)cc1.O=C(O)c1ccccn1.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.[Ir].[Ir].[Os].[Pt].c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1
InChIInChI=1S/C36H44N4.C26H22P2.C22H16N2.C12H6F4N.C12H12N2.C6H5NO2.2C4HF7O2.2Ir.Os.Pt/c1-9-21-22(10-2)30-18-32-25(13-5)28(16-8)36-20-34-27(15-7)26(14-6)33-19-35-24(12-4)23(11-3)31(39(35)40(32)36)17-29(21)37(30)38(33)34;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-7-17(8-4-1)19-11-13-23-21(15-19)22-16-20(12-14-24-22)18-9-5-2-6-10-18;13-10-4-1-8(2-5-10)11-6-3-9(7-17-11)12(14,15)16;1-9-7-10(2)14-12(8-9)11-5-3-4-6-13-11;8-6(9)5-3-1-2-4-7-5;2*5-2(6,1(12)13)3(7,8)4(9,10)11;;;;/h17-20H,9-16H2,1-8H3;1-22H;1-16H;1,3-7H;3-8H,1-2H3;1-4H,(H,8,9);2*(H,12,13);;;;/q+2;;;-1;;;;;;;;/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20+;;;;;;;;;;;
InChIKeyGGRFNEVPTHLBFZ-IUXFOZNNSA-N
XLogP26.39
TPSA211.92 Ų
H-Bond Donors1
H-Bond Acceptors13
Rotatable Bonds24
Heavy Atoms162
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002982.92
LogP ≤ 526.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid?
The IUPAC name of 2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid (CID 161160841) is 2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid.
What is the SMILES notation for 2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid?
The canonical SMILES for 2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid is C(=C[PH+](c1ccccc1)c1ccccc1)[PH+](c1ccccc1)c1ccccc1.CCc1c(CC)c2cc3c(CC)c(CC)c4cc5c(CC)c(CC)c6cc7c(CC)c(CC)c(cc1n2[n+]65)n7[n+]34.Cc1cc(C)nc(-c2ccccn2)c1.Fc1c[c-]c(-c2ccc(C(F)(F)F)cn2)cc1.O=C(O)c1ccccn1.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.[Ir].[Ir].[Os].[Pt].c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1.
What is the InChIKey of 2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid?
The InChIKey is GGRFNEVPTHLBFZ-IUXFOZNNSA-N. The full InChI is InChI=1S/C36H44N4.C26H22P2.C22H16N2.C12H6F4N.C12H12N2.C6H5NO2.2C4HF7O2.2Ir.Os.Pt/c1-9-21-22(10-2)30-18-32-25(13-5)28(16-8)36-20-34-27(15-7)26(14-6)33-19-35-24(12-4)23(11-3)31(39(35)40(32)36)17-29(21)37(30)38(33)34;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-7-17(8-4-1)19-11-13-23-21(15-19)22-16-20(12-14-24-22)18-9-5-2-6-10-18;13-10-4-1-8(2-5-10)11-6-3-9(7-17-11)12(14,15)16;1-9-7-10(2)14-12(8-9)11-5-3-4-6-13-11;8-6(9)5-3-1-2-4-7-5;2*5-2(6,1(12)13)3(7,8)4(9,10)11;;;;/h17-20H,9-16H2,1-8H3;1-22H;1-16H;1,3-7H;3-8H,1-2H3;1-4H,(H,8,9);2*(H,12,13);;;;/q+2;;;-1;;;;;;;;/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20+;;;;;;;;;;;.
What are the key properties of 2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid?
2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid has a molecular weight of 2982.92 g/mol, XLogP of 26.39, 24 rotatable bonds, 1 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-pyridin-2-ylpyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);bis(iridium);5,6,10,11,16,17,21,22-octaethyl-3,14-diaza-2,13-diazoniaheptacyclo[10.10.1.14,15.02,20.03,7.09,13.014,18]tetracosa-1,4(24),5,7,9(13),10,12(23),15,17,19,21-undecaene;osmium;4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine;platinum;pyridine-2-carboxylic acid is sourced from PubChem (CID 161160841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).