5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole

C7H13NO2 — CID 59729895

IUPAC5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole
SMILESCOCC1(C)CC(C)=NO1
InChIInChI=1S/C7H13NO2/c1-6-4-7(2,5-9-3)10-8-6/h4-5H2,1-3H3
InChIKeyUHZXJYOFMFKIOI-UHFFFAOYSA-N
MW143.19 g/mol
LogP1.19
Rot. Bonds2

About 5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole

5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole (PubChem CID 59729895) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole.

Molecular Properties

Compound Name5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole
PubChem CID59729895
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole
SMILESCOCC1(C)CC(C)=NO1
InChIInChI=1S/C7H13NO2/c1-6-4-7(2,5-9-3)10-8-6/h4-5H2,1-3H3
InChIKeyUHZXJYOFMFKIOI-UHFFFAOYSA-N
XLogP1.19
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-Methyl-5-(2-methyloxiran-2-yl)-4,5-dihydro-1,2-oxazole
CID 57742208
CID 58544115
CID 58544115
CID 58544226
CID 58544226
5-(methanidyloxymethyl)-3,5-dimethyl-4H-1,2-oxazole;yttrium
CID 59729894
(5S)-5-(methoxymethyl)-3-methyl-4,5-dihydro-1,2-oxazole
CID 89224807
3-(methoxymethyl)-5,5-dimethyl-4H-1,2-oxazole
CID 123899620
3-(2-Methoxypropan-2-yl)-4,5-dihydro-1,2-oxazole
CID 123949702
4-methoxy-3,5,5-trimethyl-4H-1,2-oxazole
CID 140934005
4-(2-methoxyethoxy)-3,5,5-trimethyl-4H-1,2-oxazole
CID 140934034
5-(Methoxymethyl)-3-methyl-4,5-dihydro-1,2-oxazole
CID 142863100
7-Methyl-2,5-dioxa-6-azaspiro[3.4]oct-6-ene
CID 146290017
methane;3-(methoxymethyl)-5,5-dimethyl-4H-1,2-oxazole
CID 159243780

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole?
The IUPAC name of 5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole (CID 59729895) is 5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole.
What is the SMILES notation for 5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole?
The canonical SMILES for 5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole is COCC1(C)CC(C)=NO1.
What is the InChIKey of 5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole?
The InChIKey is UHZXJYOFMFKIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-6-4-7(2,5-9-3)10-8-6/h4-5H2,1-3H3.
What are the key properties of 5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole?
5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole has a molecular weight of 143.19 g/mol, XLogP of 1.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-3,5-dimethyl-4H-1,2-oxazole is sourced from PubChem (CID 59729895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).