4,5-dimethylthiadiazole;methane

C6H14N2S — CID 161174748

IUPAC4,5-dimethylthiadiazole;methane
SMILESC.C.Cc1nnsc1C
InChIInChI=1S/C4H6N2S.2CH4/c1-3-4(2)7-6-5-3;;/h1-2H3;2*1H4
InChIKeyURQNWTZEXTYXKY-UHFFFAOYSA-N
MW146.26 g/mol
LogP2.43
Rot. Bonds

About 4,5-dimethylthiadiazole;methane

4,5-dimethylthiadiazole;methane (PubChem CID 161174748) has the molecular formula C6H14N2S and a molecular weight of 146.26 g/mol. Its IUPAC name is 4,5-dimethylthiadiazole;methane.

Molecular Properties

Compound Name4,5-dimethylthiadiazole;methane
PubChem CID161174748
Molecular FormulaC6H14N2S
Molecular Weight146.26 g/mol
Exact Mass146.09
IUPAC Name4,5-dimethylthiadiazole;methane
SMILESC.C.Cc1nnsc1C
InChIInChI=1S/C4H6N2S.2CH4/c1-3-4(2)7-6-5-3;;/h1-2H3;2*1H4
InChIKeyURQNWTZEXTYXKY-UHFFFAOYSA-N
XLogP2.43
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.26
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4,5-dimethylthiadiazole;methane 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 4,5-dimethylthiadiazole;methane?
The IUPAC name of 4,5-dimethylthiadiazole;methane (CID 161174748) is 4,5-dimethylthiadiazole;methane.
What is the SMILES notation for 4,5-dimethylthiadiazole;methane?
The canonical SMILES for 4,5-dimethylthiadiazole;methane is C.C.Cc1nnsc1C.
What is the InChIKey of 4,5-dimethylthiadiazole;methane?
The InChIKey is URQNWTZEXTYXKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2S.2CH4/c1-3-4(2)7-6-5-3;;/h1-2H3;2*1H4.
What are the key properties of 4,5-dimethylthiadiazole;methane?
4,5-dimethylthiadiazole;methane has a molecular weight of 146.26 g/mol, XLogP of 2.43, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethylthiadiazole;methane is sourced from PubChem (CID 161174748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).