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

C29H22N3O2Pt- — CID 176605761

About 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum

3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum (PubChem CID 176605761) has the molecular formula C29H22N3O2Pt- and a molecular weight of 639.59 g/mol. Its IUPAC name is 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum.

Molecular Properties

• Compound Name: 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
• PubChem CID: 176605761
• Molecular Formula: C29H22N3O2Pt-
• Molecular Weight: 639.59 g/mol
• Exact Mass: 639.14
• IUPAC Name: 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
• SMILES: Cc1ccnc(-n2c3[c-]c(Oc4nc5c(O)cccc5cc4C)ccc3c3cc(C)ccc32)c1.[Pt]
• InChI: InChI=1S/C29H22N3O2.Pt/c1-17-7-10-24-23(13-17)22-9-8-21(16-25(22)32(24)27-14-18(2)11-12-30-27)34-29-19(3)15-20-5-4-6-26(33)28(20)31-29;/h4-15,33H,1-3H3;/q-1
• InChIKey: UNODPZWUPZXKFH-UHFFFAOYSA-N
• XLogP: 6.95
• TPSA: 60.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	639.59
LogP ≤ 5	6.95
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 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

The IUPAC name of 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum (CID 176605761) is 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum.

What is the SMILES notation for 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

The canonical SMILES for 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum is Cc1ccnc(-n2c3[c-]c(Oc4nc5c(O)cccc5cc4C)ccc3c3cc(C)ccc32)c1.[Pt].

What is the InChIKey of 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

The InChIKey is UNODPZWUPZXKFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H22N3O2.Pt/c1-17-7-10-24-23(13-17)22-9-8-21(16-25(22)32(24)27-14-18(2)11-12-30-27)34-29-19(3)15-20-5-4-6-26(33)28(20)31-29;/h4-15,33H,1-3H3;/q-1;.

What are the key properties of 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum has a molecular weight of 639.59 g/mol, XLogP of 6.95, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum is sourced from PubChem (CID 176605761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).