4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one

C7H11NO3 — CID 14083777

IUPAC4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one
SMILESC=CCC1OC(=O)NC1OC
InChIInChI=1S/C7H11NO3/c1-3-4-5-6(10-2)8-7(9)11-5/h3,5-6H,1,4H2,2H3,(H,8,9)
InChIKeyQYWAVRDICZEAFN-UHFFFAOYSA-N
MW157.17 g/mol
LogP0.64
Rot. Bonds3

About 4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one

4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one (PubChem CID 14083777) has the molecular formula C7H11NO3 and a molecular weight of 157.17 g/mol. Its IUPAC name is 4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one
PubChem CID14083777
Molecular FormulaC7H11NO3
Molecular Weight157.17 g/mol
Exact Mass157.07
IUPAC Name4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one
SMILESC=CCC1OC(=O)NC1OC
InChIInChI=1S/C7H11NO3/c1-3-4-5-6(10-2)8-7(9)11-5/h3,5-6H,1,4H2,2H3,(H,8,9)
InChIKeyQYWAVRDICZEAFN-UHFFFAOYSA-N
XLogP0.64
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.17
LogP ≤ 50.64
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

4-propan-2-yl-5-prop-2-enyl-1,3-oxazolidin-2-one
CID 14023307
(4S,5S)-4-(3-methoxyphenyl)-5-prop-2-enyl-1,3-oxazolidin-2-one
CID 89033364
4,5-bis(prop-2-enyl)-1,3-dioxolan-2-one
CID 67427940
(4R,5S)-4-[(4S,5R)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-prop-2-enyl-1,3-oxazolidin-2-one
CID 42646423
(4R,5R)-5-[(2S)-1-hydroxypropan-2-yl]-4-methoxy-1,3-oxazolidin-2-one
CID 102316859
(4S,5S)-4-ethenyl-5-methyl-1,3-oxazolidin-2-one
CID 130984881
(4S,5R)-5-ethenyl-4-methyl-1,3-oxazolidin-2-one
CID 14841707
(3aR,6S,7S,7aR)-7-methoxy-2,2-dimethyl-6-prop-2-enyl-3a,6,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran-4-one
CID 153365008
4-prop-2-enyl-1,3-dioxetan-2-one
CID 172773496
5-methyl-4-prop-2-enyloxolan-2-one
CID 14489431
5-ethenyl-4-propan-2-yl-1,3-oxazolidin-2-one
CID 14325962
(3R,4S)-3-methyl-4-prop-2-enylazetidin-2-one
CID 55303809

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one?
The IUPAC name of 4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one (CID 14083777) is 4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one?
The canonical SMILES for 4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one is C=CCC1OC(=O)NC1OC.
What is the InChIKey of 4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one?
The InChIKey is QYWAVRDICZEAFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO3/c1-3-4-5-6(10-2)8-7(9)11-5/h3,5-6H,1,4H2,2H3,(H,8,9).
What are the key properties of 4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one?
4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one has a molecular weight of 157.17 g/mol, XLogP of 0.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-5-prop-2-enyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 14083777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).