1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)

C₄₁H₄₄GeN₂OPt — CID 172528382

About 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)

1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+) (PubChem CID 172528382) has the molecular formula C₄₁H₄₄GeN₂OPt and a molecular weight of 848.50 g/mol. Its IUPAC name is 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+).

Molecular Properties

• Compound Name: 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)
• PubChem CID: 172528382
• Molecular Formula: C₄₁H₄₄GeN₂OPt
• Molecular Weight: 848.50 g/mol
• Exact Mass: 849.23
• IUPAC Name: 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)
• SMILES: Cc1cc(Oc2[c-]c(-c3nccc4c3-c3ccc(CC(C)(C)C)cc3[Ge]4(C)C)cc(C)c2)[c-]c(-c2cc(C(C)(C)C)ccn2)c1.[Pt+2]
• InChI: InChI=1S/C41H44GeN2O.Pt/c1-26-17-29(37-24-31(13-15-43-37)41(6,7)8)22-32(19-26)45-33-20-27(2)18-30(23-33)39-38-34-12-11-28(25-40(3,4)5)21-36(34)42(9,10)35(38)14-16-44-39;/h11-21,24H,25H2,1-10H3;/q-2;+2
• InChIKey: CKAMQYLFDFRPJT-UHFFFAOYSA-N
• XLogP: 9.51
• TPSA: 35.01 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 5
• Heavy Atoms: 46
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	848.50
LogP ≤ 5	9.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)?

The IUPAC name of 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+) (CID 172528382) is 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+).

What is the SMILES notation for 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)?

The canonical SMILES for 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+) is Cc1cc(Oc2[c-]c(-c3nccc4c3-c3ccc(CC(C)(C)C)cc3[Ge]4(C)C)cc(C)c2)[c-]c(-c2cc(C(C)(C)C)ccn2)c1.[Pt+2].

What is the InChIKey of 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)?

The InChIKey is CKAMQYLFDFRPJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H44GeN2O.Pt/c1-26-17-29(37-24-31(13-15-43-37)41(6,7)8)22-32(19-26)45-33-20-27(2)18-30(23-33)39-38-34-12-11-28(25-40(3,4)5)21-36(34)42(9,10)35(38)14-16-44-39;/h11-21,24H,25H2,1-10H3;/q-2;+2.

What are the key properties of 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)?

1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+) has a molecular weight of 848.50 g/mol, XLogP of 9.51, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+) is sourced from PubChem (CID 172528382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 172528382 — identifiers, structure, computed properties (public domain)

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