platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone)

C20H14N4O2Pt — CID 139205859

IUPACplatinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone)
SMILESO=C(c1ccccn1)c1ccc[n-]1.O=C(c1ccccn1)c1ccc[n-]1.[Pt+2]
InChIInChI=1S/2C10H8N2O.Pt/c2*13-10(9-5-3-7-12-9)8-4-1-2-6-11-8;/h2*1-7H,(H,12,13);/q;;+2/p-2
InChIKeyJTEJGAWMJLIAMX-UHFFFAOYSA-L
MW537.44 g/mol
LogP2.54
Rot. Bonds4

About platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone)

platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone) (PubChem CID 139205859) has the molecular formula C20H14N4O2Pt and a molecular weight of 537.44 g/mol. Its IUPAC name is platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone).

Molecular Properties

Compound Nameplatinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone)
PubChem CID139205859
Molecular FormulaC20H14N4O2Pt
Molecular Weight537.44 g/mol
Exact Mass537.08
IUPAC Nameplatinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone)
SMILESO=C(c1ccccn1)c1ccc[n-]1.O=C(c1ccccn1)c1ccc[n-]1.[Pt+2]
InChIInChI=1S/2C10H8N2O.Pt/c2*13-10(9-5-3-7-12-9)8-4-1-2-6-11-8;/h2*1-7H,(H,12,13);/q;;+2/p-2
InChIKeyJTEJGAWMJLIAMX-UHFFFAOYSA-L
XLogP2.54
TPSA88.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500537.44
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone)?
The IUPAC name of platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone) (CID 139205859) is platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone).
What is the SMILES notation for platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone)?
The canonical SMILES for platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone) is O=C(c1ccccn1)c1ccc[n-]1.O=C(c1ccccn1)c1ccc[n-]1.[Pt+2].
What is the InChIKey of platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone)?
The InChIKey is JTEJGAWMJLIAMX-UHFFFAOYSA-L. The full InChI is InChI=1S/2C10H8N2O.Pt/c2*13-10(9-5-3-7-12-9)8-4-1-2-6-11-8;/h2*1-7H,(H,12,13);/q;;+2/p-2.
What are the key properties of platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone)?
platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone) has a molecular weight of 537.44 g/mol, XLogP of 2.54, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for platinum(2+);bis(pyridin-2-yl(pyrrol-1-id-2-yl)methanone) is sourced from PubChem (CID 139205859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).