3-hydroxy-1,3-diphenylquinoline-2,4-dione

C21H15NO3 — CID 2784001

IUPAC3-hydroxy-1,3-diphenylquinoline-2,4-dione
SMILESO=C1c2ccccc2N(c2ccccc2)C(=O)C1(O)c1ccccc1
InChIInChI=1S/C21H15NO3/c23-19-17-13-7-8-14-18(17)22(16-11-5-2-6-12-16)20(24)21(19,25)15-9-3-1-4-10-15/h1-14,25H
InChIKeyWLHCHYBWLVNEOP-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.44
Rot. Bonds2

About 3-hydroxy-1,3-diphenylquinoline-2,4-dione

3-hydroxy-1,3-diphenylquinoline-2,4-dione (PubChem CID 2784001) has the molecular formula C21H15NO3 and a molecular weight of 329.36 g/mol. Its IUPAC name is 3-hydroxy-1,3-diphenylquinoline-2,4-dione.

Molecular Properties

Compound Name3-hydroxy-1,3-diphenylquinoline-2,4-dione
PubChem CID2784001
Molecular FormulaC21H15NO3
Molecular Weight329.36 g/mol
Exact Mass329.11
IUPAC Name3-hydroxy-1,3-diphenylquinoline-2,4-dione
SMILESO=C1c2ccccc2N(c2ccccc2)C(=O)C1(O)c1ccccc1
InChIInChI=1S/C21H15NO3/c23-19-17-13-7-8-14-18(17)22(16-11-5-2-6-12-16)20(24)21(19,25)15-9-3-1-4-10-15/h1-14,25H
InChIKeyWLHCHYBWLVNEOP-UHFFFAOYSA-N
XLogP3.44
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1,3-diphenylquinoline-2,4-dione?
The IUPAC name of 3-hydroxy-1,3-diphenylquinoline-2,4-dione (CID 2784001) is 3-hydroxy-1,3-diphenylquinoline-2,4-dione.
What is the SMILES notation for 3-hydroxy-1,3-diphenylquinoline-2,4-dione?
The canonical SMILES for 3-hydroxy-1,3-diphenylquinoline-2,4-dione is O=C1c2ccccc2N(c2ccccc2)C(=O)C1(O)c1ccccc1.
What is the InChIKey of 3-hydroxy-1,3-diphenylquinoline-2,4-dione?
The InChIKey is WLHCHYBWLVNEOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15NO3/c23-19-17-13-7-8-14-18(17)22(16-11-5-2-6-12-16)20(24)21(19,25)15-9-3-1-4-10-15/h1-14,25H.
What are the key properties of 3-hydroxy-1,3-diphenylquinoline-2,4-dione?
3-hydroxy-1,3-diphenylquinoline-2,4-dione has a molecular weight of 329.36 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1,3-diphenylquinoline-2,4-dione is sourced from PubChem (CID 2784001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).