2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+))

C148H125N9O2Pt3Si2 — CID 160962725

IUPAC2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+))
SMILESCc1ccc(C)c(N(c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)cc(-c3cc4ccc(C)cc4o3)c2)c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)cc(-c3cc4ccc(C)cc4o3)c2)c1.Cc1ccc(C)c(N(c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)ccc2)c2[c-]c(-c3cc(-c4ccccc4)c([Si](C)(C)C)cn3)ccc2)c1.Cc1ccc(C)c(N(c2[c-]c(-c3cc([Si](C)(C)C)ccn3)ccc2)c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C62H47N3O2.C46H41N3Si.C40H37N3Si.3Pt/c1-38-17-20-41(4)58(23-38)65(52-28-48(56-34-54(42(5)36-63-56)44-13-9-7-10-14-44)26-50(30-52)61-32-46-21-18-39(2)24-59(46)66-61)53-29-49(57-35-55(43(6)37-64-57)45-15-11-8-12-16-45)27-51(31-53)62-33-47-22-19-40(3)25-60(47)67-62;1-32-23-24-33(2)45(25-32)49(39-21-13-19-37(26-39)43-28-41(34(3)30-47-43)35-15-9-7-10-16-35)40-22-14-20-38(27-40)44-29-42(36-17-11-8-12-18-36)46(31-48-44)50(4,5)6;1-28-18-19-29(2)40(22-28)43(34-16-10-14-32(23-34)38-25-36(20-21-41-38)44(4,5)6)35-17-11-15-33(24-35)39-26-37(30(3)27-42-39)31-12-8-7-9-13-31;;;/h7-27,30-37H,1-6H3;7-25,28-31H,1-6H3;7-22,25-27H,1-6H3;;;/q3*-2;3*+2
InChIKeyCEYHAQXKHISUQI-UHFFFAOYSA-N
MW2703.09 g/mol
LogP38.59
Rot. Bonds24

About 2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+))

2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+)) (PubChem CID 160962725) has the molecular formula C148H125N9O2Pt3Si2 and a molecular weight of 2703.09 g/mol. Its IUPAC name is 2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+)).

Molecular Properties

Compound Name2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+))
PubChem CID160962725
Molecular FormulaC148H125N9O2Pt3Si2
Molecular Weight2703.09 g/mol
Exact Mass2700.84
IUPAC Name2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+))
SMILESCc1ccc(C)c(N(c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)cc(-c3cc4ccc(C)cc4o3)c2)c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)cc(-c3cc4ccc(C)cc4o3)c2)c1.Cc1ccc(C)c(N(c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)ccc2)c2[c-]c(-c3cc(-c4ccccc4)c([Si](C)(C)C)cn3)ccc2)c1.Cc1ccc(C)c(N(c2[c-]c(-c3cc([Si](C)(C)C)ccn3)ccc2)c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C62H47N3O2.C46H41N3Si.C40H37N3Si.3Pt/c1-38-17-20-41(4)58(23-38)65(52-28-48(56-34-54(42(5)36-63-56)44-13-9-7-10-14-44)26-50(30-52)61-32-46-21-18-39(2)24-59(46)66-61)53-29-49(57-35-55(43(6)37-64-57)45-15-11-8-12-16-45)27-51(31-53)62-33-47-22-19-40(3)25-60(47)67-62;1-32-23-24-33(2)45(25-32)49(39-21-13-19-37(26-39)43-28-41(34(3)30-47-43)35-15-9-7-10-16-35)40-22-14-20-38(27-40)44-29-42(36-17-11-8-12-18-36)46(31-48-44)50(4,5)6;1-28-18-19-29(2)40(22-28)43(34-16-10-14-32(23-34)38-25-36(20-21-41-38)44(4,5)6)35-17-11-15-33(24-35)39-26-37(30(3)27-42-39)31-12-8-7-9-13-31;;;/h7-27,30-37H,1-6H3;7-25,28-31H,1-6H3;7-22,25-27H,1-6H3;;;/q3*-2;3*+2
InChIKeyCEYHAQXKHISUQI-UHFFFAOYSA-N
XLogP38.59
TPSA113.34 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds24
Heavy Atoms164
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002703.09
LogP ≤ 538.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

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

Analyze 2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+)) with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+))?
The IUPAC name of 2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+)) (CID 160962725) is 2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+)).
What is the SMILES notation for 2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+))?
The canonical SMILES for 2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+)) is Cc1ccc(C)c(N(c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)cc(-c3cc4ccc(C)cc4o3)c2)c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)cc(-c3cc4ccc(C)cc4o3)c2)c1.Cc1ccc(C)c(N(c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)ccc2)c2[c-]c(-c3cc(-c4ccccc4)c([Si](C)(C)C)cn3)ccc2)c1.Cc1ccc(C)c(N(c2[c-]c(-c3cc([Si](C)(C)C)ccn3)ccc2)c2[c-]c(-c3cc(-c4ccccc4)c(C)cn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+))?
The InChIKey is CEYHAQXKHISUQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H47N3O2.C46H41N3Si.C40H37N3Si.3Pt/c1-38-17-20-41(4)58(23-38)65(52-28-48(56-34-54(42(5)36-63-56)44-13-9-7-10-14-44)26-50(30-52)61-32-46-21-18-39(2)24-59(46)66-61)53-29-49(57-35-55(43(6)37-64-57)45-15-11-8-12-16-45)27-51(31-53)62-33-47-22-19-40(3)25-60(47)67-62;1-32-23-24-33(2)45(25-32)49(39-21-13-19-37(26-39)43-28-41(34(3)30-47-43)35-15-9-7-10-16-35)40-22-14-20-38(27-40)44-29-42(36-17-11-8-12-18-36)46(31-48-44)50(4,5)6;1-28-18-19-29(2)40(22-28)43(34-16-10-14-32(23-34)38-25-36(20-21-41-38)44(4,5)6)35-17-11-15-33(24-35)39-26-37(30(3)27-42-39)31-12-8-7-9-13-31;;;/h7-27,30-37H,1-6H3;7-25,28-31H,1-6H3;7-22,25-27H,1-6H3;;;/q3*-2;3*+2.
What are the key properties of 2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+))?
2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+)) has a molecular weight of 2703.09 g/mol, XLogP of 38.59, 24 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-phenyl-5-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;2,5-dimethyl-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-N-[3-(4-trimethylsilyl-2-pyridinyl)benzene-2-id-1-yl]aniline;N-(2,5-dimethylphenyl)-3-(6-methyl-1-benzofuran-2-yl)-N-[3-(6-methyl-1-benzofuran-2-yl)-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-amine;tris(platinum(2+)) is sourced from PubChem (CID 160962725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).