3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole

C6H10N2O2S — CID 135170701

IUPAC3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole
SMILESCOCCOc1nsc(C)n1
InChIInChI=1S/C6H10N2O2S/c1-5-7-6(8-11-5)10-4-3-9-2/h3-4H2,1-2H3
InChIKeyDGTLJUZYFKFKTO-UHFFFAOYSA-N
MW174.22 g/mol
LogP0.87
Rot. Bonds4

About 3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole

3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole (PubChem CID 135170701) has the molecular formula C6H10N2O2S and a molecular weight of 174.22 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole
PubChem CID135170701
Molecular FormulaC6H10N2O2S
Molecular Weight174.22 g/mol
Exact Mass174.05
IUPAC Name3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole
SMILESCOCCOc1nsc(C)n1
InChIInChI=1S/C6H10N2O2S/c1-5-7-6(8-11-5)10-4-3-9-2/h3-4H2,1-2H3
InChIKeyDGTLJUZYFKFKTO-UHFFFAOYSA-N
XLogP0.87
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.22
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-Methoxy-5-methyl-1,2,4-thiadiazole
CID 58328470
3-But-2-ynoxy-5-methyl-1,2,4-thiadiazole
CID 59141936
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-Ethoxy-5-methyl-1,2,4-thiadiazole
CID 149349626
5-Ethyl-3-(2-methoxyethoxy)-1,2,4-thiadiazole
CID 155406622
5-Methyl-3-(2-methylpropoxy)-1,2,4-thiadiazole
CID 155742643
5-(2-Methoxyethoxymethyl)-1,2,4-thiadiazol-3-amine
CID 108049693
3-Bromo-5-(2-methoxyethoxymethyl)-1,2,4-thiadiazole
CID 108058744
3-Iodo-5-(2-methoxyethoxymethyl)-1,2,4-thiadiazole
CID 108058745

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole?
The IUPAC name of 3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole (CID 135170701) is 3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole.
What is the SMILES notation for 3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole?
The canonical SMILES for 3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole is COCCOc1nsc(C)n1.
What is the InChIKey of 3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole?
The InChIKey is DGTLJUZYFKFKTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2S/c1-5-7-6(8-11-5)10-4-3-9-2/h3-4H2,1-2H3.
What are the key properties of 3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole?
3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole has a molecular weight of 174.22 g/mol, XLogP of 0.87, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-5-methyl-1,2,4-thiadiazole is sourced from PubChem (CID 135170701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).