5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one

C6H9NO3 — CID 66588330

IUPAC5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one
SMILESC=CC1OC(=O)N(C)C1O
InChIInChI=1S/C6H9NO3/c1-3-4-5(8)7(2)6(9)10-4/h3-5,8H,1H2,2H3
InChIKeyPZAGQLHOGDSZQV-UHFFFAOYSA-N
MW143.14 g/mol
LogP-0.06
Rot. Bonds1

About 5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one

5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one (PubChem CID 66588330) has the molecular formula C6H9NO3 and a molecular weight of 143.14 g/mol. Its IUPAC name is 5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one
PubChem CID66588330
Molecular FormulaC6H9NO3
Molecular Weight143.14 g/mol
Exact Mass143.06
IUPAC Name5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one
SMILESC=CC1OC(=O)N(C)C1O
InChIInChI=1S/C6H9NO3/c1-3-4-5(8)7(2)6(9)10-4/h3-5,8H,1H2,2H3
InChIKeyPZAGQLHOGDSZQV-UHFFFAOYSA-N
XLogP-0.06
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.14
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
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-4-hydroxy-3-methyl-1,3-oxazolidin-2-one?
The IUPAC name of 5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one (CID 66588330) is 5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one?
The canonical SMILES for 5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one is C=CC1OC(=O)N(C)C1O.
What is the InChIKey of 5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one?
The InChIKey is PZAGQLHOGDSZQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO3/c1-3-4-5(8)7(2)6(9)10-4/h3-5,8H,1H2,2H3.
What are the key properties of 5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one?
5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one has a molecular weight of 143.14 g/mol, XLogP of -0.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-4-hydroxy-3-methyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 66588330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).