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

C7H11NOS — CID 123316182

IUPAC4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole
SMILESCSC(C)c1nc(C)co1
InChIInChI=1S/C7H11NOS/c1-5-4-9-7(8-5)6(2)10-3/h4,6H,1-3H3
InChIKeyGOLMULPDEOWRCE-UHFFFAOYSA-N
MW157.24 g/mol
LogP2.41
Rot. Bonds2

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

4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole (PubChem CID 123316182) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole.

Molecular Properties

Compound Name4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole
PubChem CID123316182
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole
SMILESCSC(C)c1nc(C)co1
InChIInChI=1S/C7H11NOS/c1-5-4-9-7(8-5)6(2)10-3/h4,6H,1-3H3
InChIKeyGOLMULPDEOWRCE-UHFFFAOYSA-N
XLogP2.41
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-methyl-2-(1-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 4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole?
The IUPAC name of 4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole (CID 123316182) is 4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole.
What is the SMILES notation for 4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole?
The canonical SMILES for 4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole is CSC(C)c1nc(C)co1.
What is the InChIKey of 4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole?
The InChIKey is GOLMULPDEOWRCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-5-4-9-7(8-5)6(2)10-3/h4,6H,1-3H3.
What are the key properties of 4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole?
4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole has a molecular weight of 157.24 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(1-methylsulfanylethyl)-1,3-oxazole is sourced from PubChem (CID 123316182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).