3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one

C6H9NO3 — CID 67712152

IUPAC3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one
SMILESC=CC(O)N1COCC1=O
InChIInChI=1S/C6H9NO3/c1-2-5(8)7-4-10-3-6(7)9/h2,5,8H,1,3-4H2
InChIKeyMXXVHINMKLZMSF-UHFFFAOYSA-N
MW143.14 g/mol
LogP-0.69
Rot. Bonds2

About 3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one

3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one (PubChem CID 67712152) has the molecular formula C6H9NO3 and a molecular weight of 143.14 g/mol. Its IUPAC name is 3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one.

Molecular Properties

Compound Name3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one
PubChem CID67712152
Molecular FormulaC6H9NO3
Molecular Weight143.14 g/mol
Exact Mass143.06
IUPAC Name3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one
SMILESC=CC(O)N1COCC1=O
InChIInChI=1S/C6H9NO3/c1-2-5(8)7-4-10-3-6(7)9/h2,5,8H,1,3-4H2
InChIKeyMXXVHINMKLZMSF-UHFFFAOYSA-N
XLogP-0.69
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.14
LogP ≤ 5-0.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Oxyallyl-oxazolidinone
CID 69992313
3-Prop-2-enyl-1,3-oxazolidin-4-one
CID 69621688
3-Prop-2-enyl-1,3-oxazolidin-2-id-4-one
CID 154421048
4-(1-Hydroxyprop-2-enyl)morpholin-3-one
CID 173074433
N-(2-hydroxyethyl)-2-methoxy-N-prop-2-enylacetamide
CID 115775679

Frequently Asked Questions

What is the IUPAC name of 3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one?
The IUPAC name of 3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one (CID 67712152) is 3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one.
What is the SMILES notation for 3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one?
The canonical SMILES for 3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one is C=CC(O)N1COCC1=O.
What is the InChIKey of 3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one?
The InChIKey is MXXVHINMKLZMSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO3/c1-2-5(8)7-4-10-3-6(7)9/h2,5,8H,1,3-4H2.
What are the key properties of 3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one?
3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one has a molecular weight of 143.14 g/mol, XLogP of -0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-hydroxyprop-2-enyl)-1,3-oxazolidin-4-one is sourced from PubChem (CID 67712152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).