5-(methoxymethyl)-1,2-oxazole

C5H7NO2 — CID 19375004

IUPAC5-(methoxymethyl)-1,2-oxazole
SMILESCOCc1ccno1
InChIInChI=1S/C5H7NO2/c1-7-4-5-2-3-6-8-5/h2-3H,4H2,1H3
InChIKeyLOZGFOHKYMETIB-UHFFFAOYSA-N
MW113.12 g/mol
LogP0.82
Rot. Bonds2

About 5-(methoxymethyl)-1,2-oxazole

5-(methoxymethyl)-1,2-oxazole (PubChem CID 19375004) has the molecular formula C5H7NO2 and a molecular weight of 113.12 g/mol. Its IUPAC name is 5-(methoxymethyl)-1,2-oxazole.

Molecular Properties

Compound Name5-(methoxymethyl)-1,2-oxazole
PubChem CID19375004
Molecular FormulaC5H7NO2
Molecular Weight113.12 g/mol
Exact Mass113.05
IUPAC Name5-(methoxymethyl)-1,2-oxazole
SMILESCOCc1ccno1
InChIInChI=1S/C5H7NO2/c1-7-4-5-2-3-6-8-5/h2-3H,4H2,1H3
InChIKeyLOZGFOHKYMETIB-UHFFFAOYSA-N
XLogP0.82
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-1,2-oxazole?
The IUPAC name of 5-(methoxymethyl)-1,2-oxazole (CID 19375004) is 5-(methoxymethyl)-1,2-oxazole.
What is the SMILES notation for 5-(methoxymethyl)-1,2-oxazole?
The canonical SMILES for 5-(methoxymethyl)-1,2-oxazole is COCc1ccno1.
What is the InChIKey of 5-(methoxymethyl)-1,2-oxazole?
The InChIKey is LOZGFOHKYMETIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO2/c1-7-4-5-2-3-6-8-5/h2-3H,4H2,1H3.
What are the key properties of 5-(methoxymethyl)-1,2-oxazole?
5-(methoxymethyl)-1,2-oxazole has a molecular weight of 113.12 g/mol, XLogP of 0.82, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-1,2-oxazole is sourced from PubChem (CID 19375004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).