3,4-diphenylpiperazine-2,6-dione

C16H14N2O2 — CID 73346350

IUPAC3,4-diphenylpiperazine-2,6-dione
SMILESO=C1CN(c2ccccc2)C(c2ccccc2)C(=O)N1
InChIInChI=1S/C16H14N2O2/c19-14-11-18(13-9-5-2-6-10-13)15(16(20)17-14)12-7-3-1-4-8-12/h1-10,15H,11H2,(H,17,19,20)
InChIKeyUBCOGYJRBLFGPC-UHFFFAOYSA-N
MW266.30 g/mol
LogP1.89
Rot. Bonds2

About 3,4-diphenylpiperazine-2,6-dione

3,4-diphenylpiperazine-2,6-dione (PubChem CID 73346350) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 3,4-diphenylpiperazine-2,6-dione.

Molecular Properties

Compound Name3,4-diphenylpiperazine-2,6-dione
PubChem CID73346350
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name3,4-diphenylpiperazine-2,6-dione
SMILESO=C1CN(c2ccccc2)C(c2ccccc2)C(=O)N1
InChIInChI=1S/C16H14N2O2/c19-14-11-18(13-9-5-2-6-10-13)15(16(20)17-14)12-7-3-1-4-8-12/h1-10,15H,11H2,(H,17,19,20)
InChIKeyUBCOGYJRBLFGPC-UHFFFAOYSA-N
XLogP1.89
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.89
H-Bond Donors ≤ 51
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 3,4-diphenylpiperazine-2,6-dione?
The IUPAC name of 3,4-diphenylpiperazine-2,6-dione (CID 73346350) is 3,4-diphenylpiperazine-2,6-dione.
What is the SMILES notation for 3,4-diphenylpiperazine-2,6-dione?
The canonical SMILES for 3,4-diphenylpiperazine-2,6-dione is O=C1CN(c2ccccc2)C(c2ccccc2)C(=O)N1.
What is the InChIKey of 3,4-diphenylpiperazine-2,6-dione?
The InChIKey is UBCOGYJRBLFGPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c19-14-11-18(13-9-5-2-6-10-13)15(16(20)17-14)12-7-3-1-4-8-12/h1-10,15H,11H2,(H,17,19,20).
What are the key properties of 3,4-diphenylpiperazine-2,6-dione?
3,4-diphenylpiperazine-2,6-dione has a molecular weight of 266.30 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diphenylpiperazine-2,6-dione is sourced from PubChem (CID 73346350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).