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

C8H15NO2 — CID 20671521

IUPAC3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole
SMILESCOC(C)C1=NOC(C)(C)C1
InChIInChI=1S/C8H15NO2/c1-6(10-4)7-5-8(2,3)11-9-7/h6H,5H2,1-4H3
InChIKeyGNSVMVYTQZFPPX-UHFFFAOYSA-N
MW157.21 g/mol
LogP1.58
Rot. Bonds2

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

3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole (PubChem CID 20671521) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole.

Molecular Properties

Compound Name3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole
PubChem CID20671521
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole
SMILESCOC(C)C1=NOC(C)(C)C1
InChIInChI=1S/C8H15NO2/c1-6(10-4)7-5-8(2,3)11-9-7/h6H,5H2,1-4H3
InChIKeyGNSVMVYTQZFPPX-UHFFFAOYSA-N
XLogP1.58
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-N-methoxy-2,2,5,5-tetramethyloxolan-3-imine
CID 20684485
3-(2-methoxypropan-2-yl)-5,5-dimethyl-4H-1,2-oxazole
CID 58544105
CID 58544115
CID 58544115
CID 58544156
CID 58544156
CID 58544195
CID 58544195
CID 58544224
CID 58544224
CID 58544226
CID 58544226
CID 59967568
CID 59967568
N-methoxy-2,2,5,5-tetramethyloxolan-3-imine
CID 91117299
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

Frequently Asked Questions

What is the IUPAC name of 3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole?
The IUPAC name of 3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole (CID 20671521) is 3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole.
What is the SMILES notation for 3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole?
The canonical SMILES for 3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole is COC(C)C1=NOC(C)(C)C1.
What is the InChIKey of 3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole?
The InChIKey is GNSVMVYTQZFPPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-6(10-4)7-5-8(2,3)11-9-7/h6H,5H2,1-4H3.
What are the key properties of 3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole?
3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole has a molecular weight of 157.21 g/mol, XLogP of 1.58, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methoxyethyl)-5,5-dimethyl-4H-1,2-oxazole is sourced from PubChem (CID 20671521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).