4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole

C11H18N2O2 — CID 142367938

IUPAC4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole
SMILESCC.Cc1cnoc1.Cc1ncoc1C
InChIInChI=1S/C5H7NO.C4H5NO.C2H6/c1-4-5(2)7-3-6-4;1-4-2-5-6-3-4;1-2/h3H,1-2H3;2-3H,1H3;1-2H3
InChIKeyOBORAEYOABTSBL-UHFFFAOYSA-N
MW210.28 g/mol
LogP3.30
Rot. Bonds

About 4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole

4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole (PubChem CID 142367938) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole.

Molecular Properties

Compound Name4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole
PubChem CID142367938
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole
SMILESCC.Cc1cnoc1.Cc1ncoc1C
InChIInChI=1S/C5H7NO.C4H5NO.C2H6/c1-4-5(2)7-3-6-4;1-4-2-5-6-3-4;1-2/h3H,1-2H3;2-3H,1H3;1-2H3
InChIKeyOBORAEYOABTSBL-UHFFFAOYSA-N
XLogP3.30
TPSA52.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-Dimethyl-1,2-oxazole;4,5-dimethyl-1,3-oxazole;ethane;propane
CID 142385924
4-Methyl-1,2-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole
CID 142385957
3,4-Dimethyl-1,2-oxazole;4,5-dimethyl-1,3-oxazole;ethane
CID 142596823
3,4-Dimethyl-1,2-oxazole;4,5-dimethyl-1,3-oxazole;ethane
CID 142597212
Ethane;4-methyl-1,3-oxazole;5-methyl-1,2-oxazole
CID 155692309
4-Methyl-5-[1-(4-propan-2-yl-1,2-oxazol-2-ium-2-yl)propan-2-yl]-1,3-oxazole
CID 169664942

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole?
The IUPAC name of 4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole (CID 142367938) is 4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole.
What is the SMILES notation for 4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole?
The canonical SMILES for 4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole is CC.Cc1cnoc1.Cc1ncoc1C.
What is the InChIKey of 4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole?
The InChIKey is OBORAEYOABTSBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO.C4H5NO.C2H6/c1-4-5(2)7-3-6-4;1-4-2-5-6-3-4;1-2/h3H,1-2H3;2-3H,1H3;1-2H3.
What are the key properties of 4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole?
4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole has a molecular weight of 210.28 g/mol, XLogP of 3.30, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-1,3-oxazole;ethane;4-methyl-1,2-oxazole is sourced from PubChem (CID 142367938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).