3-(1-benzofuran-5-yloxy)-1,2-oxazole

C11H7NO3 — CID 140970300

IUPAC3-(1-benzofuran-5-yloxy)-1,2-oxazole
SMILESc1cc(Oc2ccc3occc3c2)no1
InChIInChI=1S/C11H7NO3/c1-2-10-8(3-5-13-10)7-9(1)15-11-4-6-14-12-11/h1-7H
InChIKeyWQXNSGGKAGPQEF-UHFFFAOYSA-N
MW201.18 g/mol
LogP3.21
Rot. Bonds2

About 3-(1-benzofuran-5-yloxy)-1,2-oxazole

3-(1-benzofuran-5-yloxy)-1,2-oxazole (PubChem CID 140970300) has the molecular formula C11H7NO3 and a molecular weight of 201.18 g/mol. Its IUPAC name is 3-(1-benzofuran-5-yloxy)-1,2-oxazole.

Molecular Properties

Compound Name3-(1-benzofuran-5-yloxy)-1,2-oxazole
PubChem CID140970300
Molecular FormulaC11H7NO3
Molecular Weight201.18 g/mol
Exact Mass201.04
IUPAC Name3-(1-benzofuran-5-yloxy)-1,2-oxazole
SMILESc1cc(Oc2ccc3occc3c2)no1
InChIInChI=1S/C11H7NO3/c1-2-10-8(3-5-13-10)7-9(1)15-11-4-6-14-12-11/h1-7H
InChIKeyWQXNSGGKAGPQEF-UHFFFAOYSA-N
XLogP3.21
TPSA48.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.18
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(1-benzofuran-5-yloxy)-1,2-oxazole?
The IUPAC name of 3-(1-benzofuran-5-yloxy)-1,2-oxazole (CID 140970300) is 3-(1-benzofuran-5-yloxy)-1,2-oxazole.
What is the SMILES notation for 3-(1-benzofuran-5-yloxy)-1,2-oxazole?
The canonical SMILES for 3-(1-benzofuran-5-yloxy)-1,2-oxazole is c1cc(Oc2ccc3occc3c2)no1.
What is the InChIKey of 3-(1-benzofuran-5-yloxy)-1,2-oxazole?
The InChIKey is WQXNSGGKAGPQEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7NO3/c1-2-10-8(3-5-13-10)7-9(1)15-11-4-6-14-12-11/h1-7H.
What are the key properties of 3-(1-benzofuran-5-yloxy)-1,2-oxazole?
3-(1-benzofuran-5-yloxy)-1,2-oxazole has a molecular weight of 201.18 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-benzofuran-5-yloxy)-1,2-oxazole is sourced from PubChem (CID 140970300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).