2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum

C31H24N5OPt- — CID 171580358

About 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum

2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum (PubChem CID 171580358) has the molecular formula C31H24N5OPt- and a molecular weight of 677.65 g/mol. Its IUPAC name is 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum.

Molecular Properties

• Compound Name: 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum
• PubChem CID: 171580358
• Molecular Formula: C31H24N5OPt-
• Molecular Weight: 677.65 g/mol
• Exact Mass: 677.16
• IUPAC Name: 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum
• SMILES: [C-]#[N+]c1ccc2c(c1)N(c1ccccn1)c1[c-]c(-c3ccc4c(C(C)C)ccc(O)c4n3)ccc1N2C.[Pt]
• InChI: InChI=1S/C31H24N5O.Pt/c1-19(2)22-11-15-29(37)31-23(22)10-12-24(34-31)20-8-13-25-27(17-20)36(30-7-5-6-16-33-30)28-18-21(32-3)9-14-26(28)35(25)4;/h5-16,18-19,37H,1-2,4H3;/q-1
• InChIKey: MQBTUZIBPLNSIO-UHFFFAOYSA-N
• XLogP: 8.03
• TPSA: 56.85 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	677.65
LogP ≤ 5	8.03
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 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum?

The IUPAC name of 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum (CID 171580358) is 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum.

What is the SMILES notation for 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum?

The canonical SMILES for 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum is [C-]#[N+]c1ccc2c(c1)N(c1ccccn1)c1[c-]c(-c3ccc4c(C(C)C)ccc(O)c4n3)ccc1N2C.[Pt].

What is the InChIKey of 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum?

The InChIKey is MQBTUZIBPLNSIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24N5O.Pt/c1-19(2)22-11-15-29(37)31-23(22)10-12-24(34-31)20-8-13-25-27(17-20)36(30-7-5-6-16-33-30)28-18-21(32-3)9-14-26(28)35(25)4;/h5-16,18-19,37H,1-2,4H3;/q-1;.

What are the key properties of 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum?

2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum has a molecular weight of 677.65 g/mol, XLogP of 8.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum is sourced from PubChem (CID 171580358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).