2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole

C11H15NO2 — CID 158740938

IUPAC2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole
SMILESCc1cc(C)on1.Cc1coc(C)c1
InChIInChI=1S/C6H8O.C5H7NO/c1-5-3-6(2)7-4-5;1-4-3-5(2)7-6-4/h3-4H,1-2H3;3H,1-2H3
InChIKeyIMHBATPXNJGTRB-UHFFFAOYSA-N
MW193.25 g/mol
LogP3.19
Rot. Bonds

About 2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole

2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole (PubChem CID 158740938) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole.

Molecular Properties

Compound Name2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole
PubChem CID158740938
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole
SMILESCc1cc(C)on1.Cc1coc(C)c1
InChIInChI=1S/C6H8O.C5H7NO/c1-5-3-6(2)7-4-5;1-4-3-5(2)7-6-4/h3-4H,1-2H3;3H,1-2H3
InChIKeyIMHBATPXNJGTRB-UHFFFAOYSA-N
XLogP3.19
TPSA39.17 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole?
The IUPAC name of 2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole (CID 158740938) is 2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole.
What is the SMILES notation for 2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole?
The canonical SMILES for 2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole is Cc1cc(C)on1.Cc1coc(C)c1.
What is the InChIKey of 2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole?
The InChIKey is IMHBATPXNJGTRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O.C5H7NO/c1-5-3-6(2)7-4-5;1-4-3-5(2)7-6-4/h3-4H,1-2H3;3H,1-2H3.
What are the key properties of 2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole?
2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole has a molecular weight of 193.25 g/mol, XLogP of 3.19, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylfuran;3,5-dimethyl-1,2-oxazole is sourced from PubChem (CID 158740938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).