5-methoxy-2,3-dihydro-1,3-oxazole

C4H7NO2 — CID 173057163

IUPAC5-methoxy-2,3-dihydro-1,3-oxazole
SMILESCOC1=CNCO1
InChIInChI=1S/C4H7NO2/c1-6-4-2-5-3-7-4/h2,5H,3H2,1H3
InChIKeyNWYQPAUZIIQQEB-UHFFFAOYSA-N
MW101.10 g/mol
LogP0.01
Rot. Bonds1

About 5-methoxy-2,3-dihydro-1,3-oxazole

5-methoxy-2,3-dihydro-1,3-oxazole (PubChem CID 173057163) has the molecular formula C4H7NO2 and a molecular weight of 101.10 g/mol. Its IUPAC name is 5-methoxy-2,3-dihydro-1,3-oxazole.

Molecular Properties

Compound Name5-methoxy-2,3-dihydro-1,3-oxazole
PubChem CID173057163
Molecular FormulaC4H7NO2
Molecular Weight101.10 g/mol
Exact Mass101.05
IUPAC Name5-methoxy-2,3-dihydro-1,3-oxazole
SMILESCOC1=CNCO1
InChIInChI=1S/C4H7NO2/c1-6-4-2-5-3-7-4/h2,5H,3H2,1H3
InChIKeyNWYQPAUZIIQQEB-UHFFFAOYSA-N
XLogP0.01
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.10
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2,3-dihydro-1,3-oxazole?
The IUPAC name of 5-methoxy-2,3-dihydro-1,3-oxazole (CID 173057163) is 5-methoxy-2,3-dihydro-1,3-oxazole.
What is the SMILES notation for 5-methoxy-2,3-dihydro-1,3-oxazole?
The canonical SMILES for 5-methoxy-2,3-dihydro-1,3-oxazole is COC1=CNCO1.
What is the InChIKey of 5-methoxy-2,3-dihydro-1,3-oxazole?
The InChIKey is NWYQPAUZIIQQEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO2/c1-6-4-2-5-3-7-4/h2,5H,3H2,1H3.
What are the key properties of 5-methoxy-2,3-dihydro-1,3-oxazole?
5-methoxy-2,3-dihydro-1,3-oxazole has a molecular weight of 101.10 g/mol, XLogP of 0.01, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2,3-dihydro-1,3-oxazole is sourced from PubChem (CID 173057163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).