1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+)

C39H38N4Pt — CID 168844737

About 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+)

1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+) (PubChem CID 168844737) has the molecular formula C39H38N4Pt and a molecular weight of 757.84 g/mol. Its IUPAC name is 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+).

Molecular Properties

• Compound Name: 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+)
• PubChem CID: 168844737
• Molecular Formula: C39H38N4Pt
• Molecular Weight: 757.84 g/mol
• Exact Mass: 757.27
• IUPAC Name: 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+)
• SMILES: Cc1ccnc(N2CCCc3ccc(C(C)(C)c4[c-]c5c(cc4)CCCN5c4cc(C)c(-c5ccccc5)cn4)[c-]c32)c1.[Pt+2]
• InChI: InChI=1S/C39H38N4.Pt/c1-27-18-19-40-37(22-27)42-20-8-12-30-14-16-32(24-35(30)42)39(3,4)33-17-15-31-13-9-21-43(36(31)25-33)38-23-28(2)34(26-41-38)29-10-6-5-7-11-29;/h5-7,10-11,14-19,22-23,26H,8-9,12-13,20-21H2,1-4H3;/q-2;+2
• InChIKey: YJMQXTRCXZTPSM-UHFFFAOYSA-N
• XLogP: 8.85
• TPSA: 32.26 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 44
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	757.84
LogP ≤ 5	8.85
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+)?

The IUPAC name of 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+) (CID 168844737) is 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+).

What is the SMILES notation for 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+)?

The canonical SMILES for 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+) is Cc1ccnc(N2CCCc3ccc(C(C)(C)c4[c-]c5c(cc4)CCCN5c4cc(C)c(-c5ccccc5)cn4)[c-]c32)c1.[Pt+2].

What is the InChIKey of 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+)?

The InChIKey is YJMQXTRCXZTPSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H38N4.Pt/c1-27-18-19-40-37(22-27)42-20-8-12-30-14-16-32(24-35(30)42)39(3,4)33-17-15-31-13-9-21-43(36(31)25-33)38-23-28(2)34(26-41-38)29-10-6-5-7-11-29;/h5-7,10-11,14-19,22-23,26H,8-9,12-13,20-21H2,1-4H3;/q-2;+2.

What are the key properties of 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+)?

1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+) has a molecular weight of 757.84 g/mol, XLogP of 8.85, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-methyl-5-phenyl-2-pyridinyl)-7-[2-[1-(4-methyl-2-pyridinyl)-2,3,4,8-tetrahydroquinolin-8-id-7-yl]propan-2-yl]-2,3,4,8-tetrahydroquinolin-8-ide;platinum(2+) is sourced from PubChem (CID 168844737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).