1-(3-phenylphenyl)pyrrole-2,5-dione

C16H11NO2 — CID 930984

IUPAC1-(3-phenylphenyl)pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1c1cccc(-c2ccccc2)c1
InChIInChI=1S/C16H11NO2/c18-15-9-10-16(19)17(15)14-8-4-7-13(11-14)12-5-2-1-3-6-12/h1-11H
InChIKeyQQAJYNGNBJIZPR-UHFFFAOYSA-N
MW249.27 g/mol
LogP2.78
Rot. Bonds2

About 1-(3-phenylphenyl)pyrrole-2,5-dione

1-(3-phenylphenyl)pyrrole-2,5-dione (PubChem CID 930984) has the molecular formula C16H11NO2 and a molecular weight of 249.27 g/mol. Its IUPAC name is 1-(3-phenylphenyl)pyrrole-2,5-dione.

Molecular Properties

Compound Name1-(3-phenylphenyl)pyrrole-2,5-dione
PubChem CID930984
Molecular FormulaC16H11NO2
Molecular Weight249.27 g/mol
Exact Mass249.08
IUPAC Name1-(3-phenylphenyl)pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1c1cccc(-c2ccccc2)c1
InChIInChI=1S/C16H11NO2/c18-15-9-10-16(19)17(15)14-8-4-7-13(11-14)12-5-2-1-3-6-12/h1-11H
InChIKeyQQAJYNGNBJIZPR-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'}

Analyze 1-(3-phenylphenyl)pyrrole-2,5-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methane;1-phenylpyrrole-2,5-dione
CID 174935875
1-[3-(2,5-dioxopyrrol-1-yl)phenyl]pyrrole-2,5-dione;propane
CID 160652387
1-[3-(2,5-dioxopyrrolidin-1-yl)phenyl]pyrrole-2,5-dione
CID 70995531
5-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-10-phenylphenazine
CID 153293260
1-[3-[3-(2,5-dioxopyrrol-1-yl)phenyl]sulfanylphenyl]pyrrole-2,5-dione
CID 90281887
1-[4-[[4-(2,5-dioxopyrrol-1-yl)phenyl]-(4-phenylphenyl)methyl]phenyl]pyrrole-2,5-dione
CID 155460089
1-[3-[[3-(2,5-dioxopyrrol-1-yl)phenoxy]-phenylmethoxy]phenyl]pyrrole-2,5-dione
CID 141170078
1-[3-[4-[3-(2,5-dioxopyrrol-1-yl)phenoxy]phenoxy]phenyl]pyrrole-2,5-dione
CID 22155630
4-[3-(1,3-dioxoisoindol-2-yl)phenyl]benzoic acid
CID 168517547
N-methylmethanamine;molecular hydrogen;1-phenylpyrrole-2,5-dione
CID 145056952
2-[3-(4-fluorophenyl)phenyl]isoindole-1,3-dione
CID 168517354
[3-(2,5-dioxopyrrol-1-yl)phenyl]-methyl-oxoazanium
CID 88882632

Frequently Asked Questions

What is the IUPAC name of 1-(3-phenylphenyl)pyrrole-2,5-dione?
The IUPAC name of 1-(3-phenylphenyl)pyrrole-2,5-dione (CID 930984) is 1-(3-phenylphenyl)pyrrole-2,5-dione.
What is the SMILES notation for 1-(3-phenylphenyl)pyrrole-2,5-dione?
The canonical SMILES for 1-(3-phenylphenyl)pyrrole-2,5-dione is O=C1C=CC(=O)N1c1cccc(-c2ccccc2)c1.
What is the InChIKey of 1-(3-phenylphenyl)pyrrole-2,5-dione?
The InChIKey is QQAJYNGNBJIZPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11NO2/c18-15-9-10-16(19)17(15)14-8-4-7-13(11-14)12-5-2-1-3-6-12/h1-11H.
What are the key properties of 1-(3-phenylphenyl)pyrrole-2,5-dione?
1-(3-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-(3-phenylphenyl)pyrrole-2,5-dione is sourced from PubChem (CID 930984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).