N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen

C4H9N3O2S2 — CID 158477957

IUPACN-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen
SMILESCc1nnc(NS(C)(=O)=O)s1.[H][H]
InChIInChI=1S/C4H7N3O2S2.H2/c1-3-5-6-4(10-3)7-11(2,8)9;/h1-2H3,(H,6,7);1H
InChIKeyHHDZOGYWFOJKBA-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.46
Rot. Bonds2

About N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen

N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen (PubChem CID 158477957) has the molecular formula C4H9N3O2S2 and a molecular weight of 195.27 g/mol. Its IUPAC name is N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen.

Molecular Properties

Compound NameN-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen
PubChem CID158477957
Molecular FormulaC4H9N3O2S2
Molecular Weight195.27 g/mol
Exact Mass195.01
IUPAC NameN-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen
SMILESCc1nnc(NS(C)(=O)=O)s1.[H][H]
InChIInChI=1S/C4H7N3O2S2.H2/c1-3-5-6-4(10-3)7-11(2,8)9;/h1-2H3,(H,6,7);1H
InChIKeyHHDZOGYWFOJKBA-UHFFFAOYSA-N
XLogP0.46
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen 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 N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen?
The IUPAC name of N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen (CID 158477957) is N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen.
What is the SMILES notation for N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen?
The canonical SMILES for N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen is Cc1nnc(NS(C)(=O)=O)s1.[H][H].
What is the InChIKey of N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen?
The InChIKey is HHDZOGYWFOJKBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3O2S2.H2/c1-3-5-6-4(10-3)7-11(2,8)9;/h1-2H3,(H,6,7);1H.
What are the key properties of N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen?
N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen has a molecular weight of 195.27 g/mol, XLogP of 0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,3,4-thiadiazol-2-yl)methanesulfonamide;molecular hydrogen is sourced from PubChem (CID 158477957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).