4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide

C14H24N2O4 — CID 159863647

IUPAC4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide
SMILESC=CC(CO)NC(=O)C(C)(C)C.C=CC1COC(=O)N1
InChIInChI=1S/C9H17NO2.C5H7NO2/c1-5-7(6-11)10-8(12)9(2,3)4;1-2-4-3-8-5(7)6-4/h5,7,11H,1,6H2,2-4H3,(H,10,12);2,4H,1,3H2,(H,6,7)
InChIKeyNRLOJTKZBGZWTF-UHFFFAOYSA-N
MW284.36 g/mol
LogP0.98
Rot. Bonds4

About 4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide

4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide (PubChem CID 159863647) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide.

Molecular Properties

Compound Name4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide
PubChem CID159863647
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide
SMILESC=CC(CO)NC(=O)C(C)(C)C.C=CC1COC(=O)N1
InChIInChI=1S/C9H17NO2.C5H7NO2/c1-5-7(6-11)10-8(12)9(2,3)4;1-2-4-3-8-5(7)6-4/h5,7,11H,1,6H2,2-4H3,(H,10,12);2,4H,1,3H2,(H,6,7)
InChIKeyNRLOJTKZBGZWTF-UHFFFAOYSA-N
XLogP0.98
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 50.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide?
The IUPAC name of 4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide (CID 159863647) is 4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide.
What is the SMILES notation for 4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide?
The canonical SMILES for 4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide is C=CC(CO)NC(=O)C(C)(C)C.C=CC1COC(=O)N1.
What is the InChIKey of 4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide?
The InChIKey is NRLOJTKZBGZWTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2.C5H7NO2/c1-5-7(6-11)10-8(12)9(2,3)4;1-2-4-3-8-5(7)6-4/h5,7,11H,1,6H2,2-4H3,(H,10,12);2,4H,1,3H2,(H,6,7).
What are the key properties of 4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide?
4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide has a molecular weight of 284.36 g/mol, XLogP of 0.98, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-1,3-oxazolidin-2-one;N-(1-hydroxybut-3-en-2-yl)-2,2-dimethylpropanamide is sourced from PubChem (CID 159863647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).