3-(furan-2-yl)-1,2-oxazole

C7H5NO2 — CID 11147745

IUPAC3-(furan-2-yl)-1,2-oxazole
SMILESc1coc(-c2ccon2)c1
InChIInChI=1S/C7H5NO2/c1-2-7(9-4-1)6-3-5-10-8-6/h1-5H
InChIKeyCSWYVAJJSBNRHX-UHFFFAOYSA-N
MW135.12 g/mol
LogP1.93
Rot. Bonds1

About 3-(furan-2-yl)-1,2-oxazole

3-(furan-2-yl)-1,2-oxazole (PubChem CID 11147745) has the molecular formula C7H5NO2 and a molecular weight of 135.12 g/mol. Its IUPAC name is 3-(furan-2-yl)-1,2-oxazole.

Molecular Properties

Compound Name3-(furan-2-yl)-1,2-oxazole
PubChem CID11147745
Molecular FormulaC7H5NO2
Molecular Weight135.12 g/mol
Exact Mass135.03
IUPAC Name3-(furan-2-yl)-1,2-oxazole
SMILESc1coc(-c2ccon2)c1
InChIInChI=1S/C7H5NO2/c1-2-7(9-4-1)6-3-5-10-8-6/h1-5H
InChIKeyCSWYVAJJSBNRHX-UHFFFAOYSA-N
XLogP1.93
TPSA39.17 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.12
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-1,2-oxazole?
The IUPAC name of 3-(furan-2-yl)-1,2-oxazole (CID 11147745) is 3-(furan-2-yl)-1,2-oxazole.
What is the SMILES notation for 3-(furan-2-yl)-1,2-oxazole?
The canonical SMILES for 3-(furan-2-yl)-1,2-oxazole is c1coc(-c2ccon2)c1.
What is the InChIKey of 3-(furan-2-yl)-1,2-oxazole?
The InChIKey is CSWYVAJJSBNRHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5NO2/c1-2-7(9-4-1)6-3-5-10-8-6/h1-5H.
What are the key properties of 3-(furan-2-yl)-1,2-oxazole?
3-(furan-2-yl)-1,2-oxazole has a molecular weight of 135.12 g/mol, XLogP of 1.93, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-1,2-oxazole is sourced from PubChem (CID 11147745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).