1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione

C18H15NO3 — CID 798730

IUPAC1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione
SMILESO=C(CN1C(=O)CCC1=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H15NO3/c20-16(12-19-17(21)10-11-18(19)22)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9H,10-12H2
InChIKeyLIBYIFXWXYKRKC-UHFFFAOYSA-N
MW293.32 g/mol
LogP2.69
Rot. Bonds4

About 1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione

1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione (PubChem CID 798730) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is 1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione
PubChem CID798730
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC Name1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione
SMILESO=C(CN1C(=O)CCC1=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H15NO3/c20-16(12-19-17(21)10-11-18(19)22)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9H,10-12H2
InChIKeyLIBYIFXWXYKRKC-UHFFFAOYSA-N
XLogP2.69
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione?
The IUPAC name of 1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione (CID 798730) is 1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione?
The canonical SMILES for 1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione is O=C(CN1C(=O)CCC1=O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione?
The InChIKey is LIBYIFXWXYKRKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3/c20-16(12-19-17(21)10-11-18(19)22)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9H,10-12H2.
What are the key properties of 1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione?
1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione has a molecular weight of 293.32 g/mol, XLogP of 2.69, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-oxo-2-(4-phenylphenyl)ethyl]pyrrolidine-2,5-dione is sourced from PubChem (CID 798730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).