5-(furan-2-ylmethyl)-1,2-oxazole

C8H7NO2 — CID 123918536

IUPAC5-(furan-2-ylmethyl)-1,2-oxazole
SMILESc1coc(Cc2ccno2)c1
InChIInChI=1S/C8H7NO2/c1-2-7(10-5-1)6-8-3-4-9-11-8/h1-5H,6H2
InChIKeyHHXRUTQLQXAUCG-UHFFFAOYSA-N
MW149.15 g/mol
LogP1.86
Rot. Bonds2

About 5-(furan-2-ylmethyl)-1,2-oxazole

5-(furan-2-ylmethyl)-1,2-oxazole (PubChem CID 123918536) has the molecular formula C8H7NO2 and a molecular weight of 149.15 g/mol. Its IUPAC name is 5-(furan-2-ylmethyl)-1,2-oxazole.

Molecular Properties

Compound Name5-(furan-2-ylmethyl)-1,2-oxazole
PubChem CID123918536
Molecular FormulaC8H7NO2
Molecular Weight149.15 g/mol
Exact Mass149.05
IUPAC Name5-(furan-2-ylmethyl)-1,2-oxazole
SMILESc1coc(Cc2ccno2)c1
InChIInChI=1S/C8H7NO2/c1-2-7(10-5-1)6-8-3-4-9-11-8/h1-5H,6H2
InChIKeyHHXRUTQLQXAUCG-UHFFFAOYSA-N
XLogP1.86
TPSA39.17 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-ylmethyl)-1,2-oxazole?
The IUPAC name of 5-(furan-2-ylmethyl)-1,2-oxazole (CID 123918536) is 5-(furan-2-ylmethyl)-1,2-oxazole.
What is the SMILES notation for 5-(furan-2-ylmethyl)-1,2-oxazole?
The canonical SMILES for 5-(furan-2-ylmethyl)-1,2-oxazole is c1coc(Cc2ccno2)c1.
What is the InChIKey of 5-(furan-2-ylmethyl)-1,2-oxazole?
The InChIKey is HHXRUTQLQXAUCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NO2/c1-2-7(10-5-1)6-8-3-4-9-11-8/h1-5H,6H2.
What are the key properties of 5-(furan-2-ylmethyl)-1,2-oxazole?
5-(furan-2-ylmethyl)-1,2-oxazole has a molecular weight of 149.15 g/mol, XLogP of 1.86, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-ylmethyl)-1,2-oxazole is sourced from PubChem (CID 123918536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).