4-ethenyl-1,3-oxazolidin-2-one

C5H7NO2 — CID 14982204

IUPAC4-ethenyl-1,3-oxazolidin-2-one
SMILESC=CC1COC(=O)N1
InChIInChI=1S/C5H7NO2/c1-2-4-3-8-5(7)6-4/h2,4H,1,3H2,(H,6,7)
InChIKeyWRQDRNWXVRNPFT-UHFFFAOYSA-N
MW113.12 g/mol
LogP0.28
Rot. Bonds1

About 4-ethenyl-1,3-oxazolidin-2-one

4-ethenyl-1,3-oxazolidin-2-one (PubChem CID 14982204) has the molecular formula C5H7NO2 and a molecular weight of 113.12 g/mol. Its IUPAC name is 4-ethenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-ethenyl-1,3-oxazolidin-2-one
PubChem CID14982204
Molecular FormulaC5H7NO2
Molecular Weight113.12 g/mol
Exact Mass113.05
IUPAC Name4-ethenyl-1,3-oxazolidin-2-one
SMILESC=CC1COC(=O)N1
InChIInChI=1S/C5H7NO2/c1-2-4-3-8-5(7)6-4/h2,4H,1,3H2,(H,6,7)
InChIKeyWRQDRNWXVRNPFT-UHFFFAOYSA-N
XLogP0.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 4-ethenyl-1,3-oxazolidin-2-one?
The IUPAC name of 4-ethenyl-1,3-oxazolidin-2-one (CID 14982204) is 4-ethenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-ethenyl-1,3-oxazolidin-2-one?
The canonical SMILES for 4-ethenyl-1,3-oxazolidin-2-one is C=CC1COC(=O)N1.
What is the InChIKey of 4-ethenyl-1,3-oxazolidin-2-one?
The InChIKey is WRQDRNWXVRNPFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO2/c1-2-4-3-8-5(7)6-4/h2,4H,1,3H2,(H,6,7).
What are the key properties of 4-ethenyl-1,3-oxazolidin-2-one?
4-ethenyl-1,3-oxazolidin-2-one has a molecular weight of 113.12 g/mol, XLogP of 0.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 14982204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).