2-(2-methoxyethyl)-3H-1,2-oxazole

C6H11NO2 — CID 174572396

IUPAC2-(2-methoxyethyl)-3H-1,2-oxazole
SMILESCOCCN1CC=CO1
InChIInChI=1S/C6H11NO2/c1-8-6-4-7-3-2-5-9-7/h2,5H,3-4,6H2,1H3
InChIKeyZEGPDRGATAFAKF-UHFFFAOYSA-N
MW129.16 g/mol
LogP0.39
Rot. Bonds3

About 2-(2-methoxyethyl)-3H-1,2-oxazole

2-(2-methoxyethyl)-3H-1,2-oxazole (PubChem CID 174572396) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-3H-1,2-oxazole.

Molecular Properties

Compound Name2-(2-methoxyethyl)-3H-1,2-oxazole
PubChem CID174572396
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Name2-(2-methoxyethyl)-3H-1,2-oxazole
SMILESCOCCN1CC=CO1
InChIInChI=1S/C6H11NO2/c1-8-6-4-7-3-2-5-9-7/h2,5H,3-4,6H2,1H3
InChIKeyZEGPDRGATAFAKF-UHFFFAOYSA-N
XLogP0.39
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 50.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(2-methoxyethyl)-3H-1,2-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-3H-1,2-oxazole?
The IUPAC name of 2-(2-methoxyethyl)-3H-1,2-oxazole (CID 174572396) is 2-(2-methoxyethyl)-3H-1,2-oxazole.
What is the SMILES notation for 2-(2-methoxyethyl)-3H-1,2-oxazole?
The canonical SMILES for 2-(2-methoxyethyl)-3H-1,2-oxazole is COCCN1CC=CO1.
What is the InChIKey of 2-(2-methoxyethyl)-3H-1,2-oxazole?
The InChIKey is ZEGPDRGATAFAKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-8-6-4-7-3-2-5-9-7/h2,5H,3-4,6H2,1H3.
What are the key properties of 2-(2-methoxyethyl)-3H-1,2-oxazole?
2-(2-methoxyethyl)-3H-1,2-oxazole has a molecular weight of 129.16 g/mol, XLogP of 0.39, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-3H-1,2-oxazole is sourced from PubChem (CID 174572396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).