5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole

C8H13NO2S — CID 14435668

IUPAC5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole
SMILESCOc1oc(C)nc1CCSC
InChIInChI=1S/C8H13NO2S/c1-6-9-7(4-5-12-3)8(10-2)11-6/h4-5H2,1-3H3
InChIKeyMVWJPZYGQKXWOS-UHFFFAOYSA-N
MW187.26 g/mol
LogP1.90
Rot. Bonds4

About 5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole

5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole (PubChem CID 14435668) has the molecular formula C8H13NO2S and a molecular weight of 187.26 g/mol. Its IUPAC name is 5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole.

Molecular Properties

Compound Name5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole
PubChem CID14435668
Molecular FormulaC8H13NO2S
Molecular Weight187.26 g/mol
Exact Mass187.07
IUPAC Name5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole
SMILESCOc1oc(C)nc1CCSC
InChIInChI=1S/C8H13NO2S/c1-6-9-7(4-5-12-3)8(10-2)11-6/h4-5H2,1-3H3
InChIKeyMVWJPZYGQKXWOS-UHFFFAOYSA-N
XLogP1.90
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole?
The IUPAC name of 5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole (CID 14435668) is 5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole.
What is the SMILES notation for 5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole?
The canonical SMILES for 5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole is COc1oc(C)nc1CCSC.
What is the InChIKey of 5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole?
The InChIKey is MVWJPZYGQKXWOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2S/c1-6-9-7(4-5-12-3)8(10-2)11-6/h4-5H2,1-3H3.
What are the key properties of 5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole?
5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole has a molecular weight of 187.26 g/mol, XLogP of 1.90, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-methyl-4-(2-methylsulfanylethyl)-1,3-oxazole is sourced from PubChem (CID 14435668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).