2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide

C7H11N3OS — CID 143219880

IUPAC2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide
SMILESCC(C)c1nsc(CC(N)=O)n1
InChIInChI=1S/C7H11N3OS/c1-4(2)7-9-6(12-10-7)3-5(8)11/h4H,3H2,1-2H3,(H2,8,11)
InChIKeySYLGMPLZPGCHAA-UHFFFAOYSA-N
MW185.25 g/mol
LogP0.69
Rot. Bonds3

About 2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide

2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide (PubChem CID 143219880) has the molecular formula C7H11N3OS and a molecular weight of 185.25 g/mol. Its IUPAC name is 2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide
PubChem CID143219880
Molecular FormulaC7H11N3OS
Molecular Weight185.25 g/mol
Exact Mass185.06
IUPAC Name2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide
SMILESCC(C)c1nsc(CC(N)=O)n1
InChIInChI=1S/C7H11N3OS/c1-4(2)7-9-6(12-10-7)3-5(8)11/h4H,3H2,1-2H3,(H2,8,11)
InChIKeySYLGMPLZPGCHAA-UHFFFAOYSA-N
XLogP0.69
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.25
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide 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 2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide?
The IUPAC name of 2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide (CID 143219880) is 2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide.
What is the SMILES notation for 2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide?
The canonical SMILES for 2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide is CC(C)c1nsc(CC(N)=O)n1.
What is the InChIKey of 2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide?
The InChIKey is SYLGMPLZPGCHAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3OS/c1-4(2)7-9-6(12-10-7)3-5(8)11/h4H,3H2,1-2H3,(H2,8,11).
What are the key properties of 2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide?
2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide has a molecular weight of 185.25 g/mol, XLogP of 0.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)acetamide is sourced from PubChem (CID 143219880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).