9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum

C67H70N5Pt-3 — CID 162449756

About 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum

9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum (PubChem CID 162449756) has the molecular formula C67H70N5Pt-3 and a molecular weight of 1140.41 g/mol. Its IUPAC name is 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum.

Molecular Properties

• Compound Name: 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum
• PubChem CID: 162449756
• Molecular Formula: C67H70N5Pt-3
• Molecular Weight: 1140.41 g/mol
• Exact Mass: 1139.53
• IUPAC Name: 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum
• SMILES: CN(c1[c-]c(N2[CH-]N(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)c3ccccc32)ccc1)c1[c-]c2c(cc1)c1cc(C(C)(C)c3ccccc3)ccc1n2-c1cc(C(C)(C)c2ccc(C(C)(C)C)cc2)ccn1.[Pt]
• InChI: InChI=1S/C67H70N5.Pt/c1-63(2,3)45-27-29-47(30-28-45)67(12,13)49-35-36-68-62(41-49)72-58-34-31-48(66(10,11)46-21-16-15-17-22-46)40-57(58)56-33-32-53(43-61(56)72)69(14)52-23-20-24-54(42-52)70-44-71(60-26-19-18-25-59(60)70)55-38-50(64(4,5)6)37-51(39-55)65(7,8)9;/h15-41,44H,1-14H3;/q-3
• InChIKey: PAEHLECCPJBIIQ-UHFFFAOYSA-N
• XLogP: 17.50
• TPSA: 27.54 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 9
• Heavy Atoms: 73
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1140.41
LogP ≤ 5	17.50
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum?

The IUPAC name of 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum (CID 162449756) is 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum.

What is the SMILES notation for 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum?

The canonical SMILES for 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum is CN(c1[c-]c(N2[CH-]N(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)c3ccccc32)ccc1)c1[c-]c2c(cc1)c1cc(C(C)(C)c3ccccc3)ccc1n2-c1cc(C(C)(C)c2ccc(C(C)(C)C)cc2)ccn1.[Pt].

What is the InChIKey of 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum?

The InChIKey is PAEHLECCPJBIIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H70N5.Pt/c1-63(2,3)45-27-29-47(30-28-45)67(12,13)49-35-36-68-62(41-49)72-58-34-31-48(66(10,11)46-21-16-15-17-22-46)40-57(58)56-33-32-53(43-61(56)72)69(14)52-23-20-24-54(42-52)70-44-71(60-26-19-18-25-59(60)70)55-38-50(64(4,5)6)37-51(39-55)65(7,8)9;/h15-41,44H,1-14H3;/q-3;.

What are the key properties of 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum?

9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum has a molecular weight of 1140.41 g/mol, XLogP of 17.50, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[4-[2-(4-tert-butylphenyl)propan-2-yl]-2-pyridinyl]-N-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-N-methyl-6-(2-phenylpropan-2-yl)-1H-carbazol-1-id-2-amine;platinum is sourced from PubChem (CID 162449756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).