ethane;4-methylthiadiazole

C5H10N2S — CID 91355906

IUPACethane;4-methylthiadiazole
SMILESCC.Cc1csnn1
InChIInChI=1S/C3H4N2S.C2H6/c1-3-2-6-5-4-3;1-2/h2H,1H3;1-2H3
InChIKeyRVWMMLJJBXYLBK-UHFFFAOYSA-N
MW130.22 g/mol
LogP1.87
Rot. Bonds

About ethane;4-methylthiadiazole

ethane;4-methylthiadiazole (PubChem CID 91355906) has the molecular formula C5H10N2S and a molecular weight of 130.22 g/mol. Its IUPAC name is ethane;4-methylthiadiazole.

Molecular Properties

Compound Nameethane;4-methylthiadiazole
PubChem CID91355906
Molecular FormulaC5H10N2S
Molecular Weight130.22 g/mol
Exact Mass130.06
IUPAC Nameethane;4-methylthiadiazole
SMILESCC.Cc1csnn1
InChIInChI=1S/C3H4N2S.C2H6/c1-3-2-6-5-4-3;1-2/h2H,1H3;1-2H3
InChIKeyRVWMMLJJBXYLBK-UHFFFAOYSA-N
XLogP1.87
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.22
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethane;4-methylthiadiazole 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 ethane;4-methylthiadiazole?
The IUPAC name of ethane;4-methylthiadiazole (CID 91355906) is ethane;4-methylthiadiazole.
What is the SMILES notation for ethane;4-methylthiadiazole?
The canonical SMILES for ethane;4-methylthiadiazole is CC.Cc1csnn1.
What is the InChIKey of ethane;4-methylthiadiazole?
The InChIKey is RVWMMLJJBXYLBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2S.C2H6/c1-3-2-6-5-4-3;1-2/h2H,1H3;1-2H3.
What are the key properties of ethane;4-methylthiadiazole?
ethane;4-methylthiadiazole has a molecular weight of 130.22 g/mol, XLogP of 1.87, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methylthiadiazole is sourced from PubChem (CID 91355906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).