5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione

C11H11NO4 — CID 579075

IUPAC5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione
SMILESCCOc1ccc(C2OC(=O)NC2=O)cc1
InChIInChI=1S/C11H11NO4/c1-2-15-8-5-3-7(4-6-8)9-10(13)12-11(14)16-9/h3-6,9H,2H2,1H3,(H,12,13,14)
InChIKeyIKHPFHGRKAFDHH-UHFFFAOYSA-N
MW221.21 g/mol
LogP1.39
Rot. Bonds3

About 5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione

5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione (PubChem CID 579075) has the molecular formula C11H11NO4 and a molecular weight of 221.21 g/mol. Its IUPAC name is 5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione
PubChem CID579075
Molecular FormulaC11H11NO4
Molecular Weight221.21 g/mol
Exact Mass221.07
IUPAC Name5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione
SMILESCCOc1ccc(C2OC(=O)NC2=O)cc1
InChIInChI=1S/C11H11NO4/c1-2-15-8-5-3-7(4-6-8)9-10(13)12-11(14)16-9/h3-6,9H,2H2,1H3,(H,12,13,14)
InChIKeyIKHPFHGRKAFDHH-UHFFFAOYSA-N
XLogP1.39
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.21
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-Pyrrolidinedione, 3-(4-(1-methylethoxy)phenyl)-
CID 214258
5-[3-[3-(2-Propylphenoxy)propoxy]phenyl]-1,3-oxazolidine-2,4-dione
CID 44345030
5-[1-(4-Phenylmethoxyphenyl)but-2-ynyl]-1,3-oxazolidine-2,4-dione
CID 54585512
5-(2,4-Dimethoxyphenyl)-1,3-oxazolidine-2,4-dione
CID 5108455
Spiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione
CID 13014158
5-(2-Methoxyphenyl)oxazolidine-2,4-dione
CID 13091999
5-(2-Ethoxyphenyl)oxazolidine-2,4-dione
CID 13092000
5-(5-Fluoro-2-methoxyphenyl)oxazolidine-2,4-dione
CID 13092004
5-(3-Phenoxyphenyl)oxazolidine-2,4-dione
CID 13092011
5-(2-Benzyloxyphenyl)oxazolidine-2,4-dione
CID 13092012
5-(2-Ethoxy-5-fluorophenyl)-1,3-oxazolidine-2,4-dione
CID 13092020
5-(3-Fluoro-2-methoxy-5-methylphenyl)-1,3-oxazolidine-2,4-dione
CID 13092021

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione?
The IUPAC name of 5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione (CID 579075) is 5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione is CCOc1ccc(C2OC(=O)NC2=O)cc1.
What is the InChIKey of 5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione?
The InChIKey is IKHPFHGRKAFDHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO4/c1-2-15-8-5-3-7(4-6-8)9-10(13)12-11(14)16-9/h3-6,9H,2H2,1H3,(H,12,13,14).
What are the key properties of 5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione?
5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione has a molecular weight of 221.21 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxyphenyl)-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 579075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).