5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione

C17H13NO3 — CID 168864617

IUPAC5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione
SMILESC=CC1(c2ccccc2)OC(=O)N(c2ccccc2)C1=O
InChIInChI=1S/C17H13NO3/c1-2-17(13-9-5-3-6-10-13)15(19)18(16(20)21-17)14-11-7-4-8-12-14/h2-12H,1H2
InChIKeyNHAGVHDIYSMUOM-UHFFFAOYSA-N
MW279.30 g/mol
LogP3.25
Rot. Bonds3

About 5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione

5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione (PubChem CID 168864617) has the molecular formula C17H13NO3 and a molecular weight of 279.30 g/mol. Its IUPAC name is 5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione
PubChem CID168864617
Molecular FormulaC17H13NO3
Molecular Weight279.30 g/mol
Exact Mass279.09
IUPAC Name5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione
SMILESC=CC1(c2ccccc2)OC(=O)N(c2ccccc2)C1=O
InChIInChI=1S/C17H13NO3/c1-2-17(13-9-5-3-6-10-13)15(19)18(16(20)21-17)14-11-7-4-8-12-14/h2-12H,1H2
InChIKeyNHAGVHDIYSMUOM-UHFFFAOYSA-N
XLogP3.25
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione?
The IUPAC name of 5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione (CID 168864617) is 5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione is C=CC1(c2ccccc2)OC(=O)N(c2ccccc2)C1=O.
What is the InChIKey of 5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione?
The InChIKey is NHAGVHDIYSMUOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO3/c1-2-17(13-9-5-3-6-10-13)15(19)18(16(20)21-17)14-11-7-4-8-12-14/h2-12H,1H2.
What are the key properties of 5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione?
5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione has a molecular weight of 279.30 g/mol, XLogP of 3.25, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 168864617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).