platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide

C31H23N3O2Pt — CID 153421196

About platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide

platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide (PubChem CID 153421196) has the molecular formula C31H23N3O2Pt and a molecular weight of 664.62 g/mol. Its IUPAC name is platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide.

Molecular Properties

• Compound Name: platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide
• PubChem CID: 153421196
• Molecular Formula: C31H23N3O2Pt
• Molecular Weight: 664.62 g/mol
• Exact Mass: 664.14
• IUPAC Name: platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide
• SMILES: CC(C)Oc1cc(Oc2ccccn2)[c-]c(-c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)c1.[Pt+2]
• InChI: InChI=1S/C31H23N3O2.Pt/c1-21(2)35-24-17-23(18-25(20-24)36-31-12-6-8-16-33-31)22-13-14-27-26-9-3-4-10-28(26)34(29(27)19-22)30-11-5-7-15-32-30;/h3-17,20-21H,1-2H3;/q-2;+2
• InChIKey: WIFLCFTXDQNHRC-UHFFFAOYSA-N
• XLogP: 7.42
• TPSA: 49.17 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	664.62
LogP ≤ 5	7.42
H-Bond Donors ≤ 5	0
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 platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide?

The IUPAC name of platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide (CID 153421196) is platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide.

What is the SMILES notation for platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide?

The canonical SMILES for platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide is CC(C)Oc1cc(Oc2ccccn2)[c-]c(-c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)c1.[Pt+2].

What is the InChIKey of platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide?

The InChIKey is WIFLCFTXDQNHRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H23N3O2.Pt/c1-21(2)35-24-17-23(18-25(20-24)36-31-12-6-8-16-33-31)22-13-14-27-26-9-3-4-10-28(26)34(29(27)19-22)30-11-5-7-15-32-30;/h3-17,20-21H,1-2H3;/q-2;+2.

What are the key properties of platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide?

platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide has a molecular weight of 664.62 g/mol, XLogP of 7.42, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide is sourced from PubChem (CID 153421196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).