1-(2-phenylphenyl)pyrrole-2,5-dione

C16H11NO2 — CID 13059262

IUPAC1-(2-phenylphenyl)pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1c1ccccc1-c1ccccc1
InChIInChI=1S/C16H11NO2/c18-15-10-11-16(19)17(15)14-9-5-4-8-13(14)12-6-2-1-3-7-12/h1-11H
InChIKeyABAMRMYDBGTLHX-UHFFFAOYSA-N
MW249.27 g/mol
LogP2.78
Rot. Bonds2

About 1-(2-phenylphenyl)pyrrole-2,5-dione

1-(2-phenylphenyl)pyrrole-2,5-dione (PubChem CID 13059262) has the molecular formula C16H11NO2 and a molecular weight of 249.27 g/mol. Its IUPAC name is 1-(2-phenylphenyl)pyrrole-2,5-dione.

Molecular Properties

Compound Name1-(2-phenylphenyl)pyrrole-2,5-dione
PubChem CID13059262
Molecular FormulaC16H11NO2
Molecular Weight249.27 g/mol
Exact Mass249.08
IUPAC Name1-(2-phenylphenyl)pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1c1ccccc1-c1ccccc1
InChIInChI=1S/C16H11NO2/c18-15-10-11-16(19)17(15)14-9-5-4-8-13(14)12-6-2-1-3-7-12/h1-11H
InChIKeyABAMRMYDBGTLHX-UHFFFAOYSA-N
XLogP2.78
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylphenyl)pyrrole-2,5-dione?
The IUPAC name of 1-(2-phenylphenyl)pyrrole-2,5-dione (CID 13059262) is 1-(2-phenylphenyl)pyrrole-2,5-dione.
What is the SMILES notation for 1-(2-phenylphenyl)pyrrole-2,5-dione?
The canonical SMILES for 1-(2-phenylphenyl)pyrrole-2,5-dione is O=C1C=CC(=O)N1c1ccccc1-c1ccccc1.
What is the InChIKey of 1-(2-phenylphenyl)pyrrole-2,5-dione?
The InChIKey is ABAMRMYDBGTLHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11NO2/c18-15-10-11-16(19)17(15)14-9-5-4-8-13(14)12-6-2-1-3-7-12/h1-11H.
What are the key properties of 1-(2-phenylphenyl)pyrrole-2,5-dione?
1-(2-phenylphenyl)pyrrole-2,5-dione has a molecular weight of 249.27 g/mol, XLogP of 2.78, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylphenyl)pyrrole-2,5-dione is sourced from PubChem (CID 13059262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).