3-ethoxy-5-methyl-1,2,4-thiadiazole

C5H8N2OS — CID 149349626

IUPAC3-ethoxy-5-methyl-1,2,4-thiadiazole
SMILESCCOc1nsc(C)n1
InChIInChI=1S/C5H8N2OS/c1-3-8-5-6-4(2)9-7-5/h3H2,1-2H3
InChIKeyYFTJQYNAIQRFIN-UHFFFAOYSA-N
MW144.20 g/mol
LogP1.25
Rot. Bonds2

About 3-ethoxy-5-methyl-1,2,4-thiadiazole

3-ethoxy-5-methyl-1,2,4-thiadiazole (PubChem CID 149349626) has the molecular formula C5H8N2OS and a molecular weight of 144.20 g/mol. Its IUPAC name is 3-ethoxy-5-methyl-1,2,4-thiadiazole.

Molecular Properties

Compound Name3-ethoxy-5-methyl-1,2,4-thiadiazole
PubChem CID149349626
Molecular FormulaC5H8N2OS
Molecular Weight144.20 g/mol
Exact Mass144.04
IUPAC Name3-ethoxy-5-methyl-1,2,4-thiadiazole
SMILESCCOc1nsc(C)n1
InChIInChI=1S/C5H8N2OS/c1-3-8-5-6-4(2)9-7-5/h3H2,1-2H3
InChIKeyYFTJQYNAIQRFIN-UHFFFAOYSA-N
XLogP1.25
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.20
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-ethoxy-5-methyl-1,2,4-thiadiazole 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

3-Ethoxy-5-trichloromethyl-1,2,4-thiadiazole
CID 67287315
(5-Ethoxy-1,2,4-thiadiazol-3-yl)methanethiol
CID 20623938
3-Methoxy-5-methyl-1,2,4-thiadiazole
CID 58328470
3-But-2-ynoxy-5-methyl-1,2,4-thiadiazole
CID 59141936
3-(Ethoxymethylsulfanyl)-5-(iodomethyl)-1,2,4-thiadiazole
CID 89317851
3-But-2-ynoxy-5-ethyl-1,2,4-thiadiazole
CID 90741617
5-Ethyl-3-methoxy-1,2,4-thiadiazole
CID 118152555
5-Methyl-3-prop-2-ynoxy-1,2,4-thiadiazole
CID 118466201
5-Ethoxy-3-methyl-1,2,4-thiadiazole
CID 119096458
3-Methoxy-5-propan-2-yl-1,2,4-thiadiazole
CID 134442994
3-(2-Methoxyethylsulfanyl)-5-methyl-1,2,4-thiadiazole
CID 135170700
3-(2-Methoxyethoxy)-5-methyl-1,2,4-thiadiazole
CID 135170701

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-5-methyl-1,2,4-thiadiazole?
The IUPAC name of 3-ethoxy-5-methyl-1,2,4-thiadiazole (CID 149349626) is 3-ethoxy-5-methyl-1,2,4-thiadiazole.
What is the SMILES notation for 3-ethoxy-5-methyl-1,2,4-thiadiazole?
The canonical SMILES for 3-ethoxy-5-methyl-1,2,4-thiadiazole is CCOc1nsc(C)n1.
What is the InChIKey of 3-ethoxy-5-methyl-1,2,4-thiadiazole?
The InChIKey is YFTJQYNAIQRFIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2OS/c1-3-8-5-6-4(2)9-7-5/h3H2,1-2H3.
What are the key properties of 3-ethoxy-5-methyl-1,2,4-thiadiazole?
3-ethoxy-5-methyl-1,2,4-thiadiazole has a molecular weight of 144.20 g/mol, XLogP of 1.25, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-5-methyl-1,2,4-thiadiazole is sourced from PubChem (CID 149349626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).