4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum

C31H26N3O2Pt- — CID 176605877

About 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum

4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum (PubChem CID 176605877) has the molecular formula C31H26N3O2Pt- and a molecular weight of 667.65 g/mol. Its IUPAC name is 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum.

Molecular Properties

• Compound Name: 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
• PubChem CID: 176605877
• Molecular Formula: C31H26N3O2Pt-
• Molecular Weight: 667.65 g/mol
• Exact Mass: 667.17
• IUPAC Name: 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
• SMILES: Cc1ccc(-n2c3[c-]c(Oc4cc(C)c5cccc(O)c5n4)ccc3c3cc(C(C)C)ccc32)nc1.[Pt]
• InChI: InChI=1S/C31H26N3O2.Pt/c1-18(2)21-9-12-26-25(15-21)24-11-10-22(16-27(24)34(26)29-13-8-19(3)17-32-29)36-30-14-20(4)23-6-5-7-28(35)31(23)33-30;/h5-15,17-18,35H,1-4H3;/q-1
• InChIKey: RUECGYXZALBUPH-UHFFFAOYSA-N
• XLogP: 7.76
• TPSA: 60.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	667.65
LogP ≤ 5	7.76
H-Bond Donors ≤ 5	1
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 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

The IUPAC name of 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum (CID 176605877) is 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum.

What is the SMILES notation for 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

The canonical SMILES for 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum is Cc1ccc(-n2c3[c-]c(Oc4cc(C)c5cccc(O)c5n4)ccc3c3cc(C(C)C)ccc32)nc1.[Pt].

What is the InChIKey of 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

The InChIKey is RUECGYXZALBUPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H26N3O2.Pt/c1-18(2)21-9-12-26-25(15-21)24-11-10-22(16-27(24)34(26)29-13-8-19(3)17-32-29)36-30-14-20(4)23-6-5-7-28(35)31(23)33-30;/h5-15,17-18,35H,1-4H3;/q-1;.

What are the key properties of 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum has a molecular weight of 667.65 g/mol, XLogP of 7.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 4-methyl-2-[[9-(5-methyl-2-pyridinyl)-6-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum is sourced from PubChem (CID 176605877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).