N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide

C8H9N5OS — CID 39723877

IUPACN-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide
SMILESCc1nnc(NC(=O)Cn2cccn2)s1
InChIInChI=1S/C8H9N5OS/c1-6-11-12-8(15-6)10-7(14)5-13-4-2-3-9-13/h2-4H,5H2,1H3,(H,10,12,14)
InChIKeyYNVGPZLQULRIDO-UHFFFAOYSA-N
MW223.26 g/mol
LogP0.68
Rot. Bonds3

About N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide

N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide (PubChem CID 39723877) has the molecular formula C8H9N5OS and a molecular weight of 223.26 g/mol. Its IUPAC name is N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound NameN-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide
PubChem CID39723877
Molecular FormulaC8H9N5OS
Molecular Weight223.26 g/mol
Exact Mass223.05
IUPAC NameN-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide
SMILESCc1nnc(NC(=O)Cn2cccn2)s1
InChIInChI=1S/C8H9N5OS/c1-6-11-12-8(15-6)10-7(14)5-13-4-2-3-9-13/h2-4H,5H2,1H3,(H,10,12,14)
InChIKeyYNVGPZLQULRIDO-UHFFFAOYSA-N
XLogP0.68
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.26
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide 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)-2-pyrazol-1-ylacetamide?
The IUPAC name of N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide (CID 39723877) is N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide.
What is the SMILES notation for N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide?
The canonical SMILES for N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide is Cc1nnc(NC(=O)Cn2cccn2)s1.
What is the InChIKey of N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide?
The InChIKey is YNVGPZLQULRIDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5OS/c1-6-11-12-8(15-6)10-7(14)5-13-4-2-3-9-13/h2-4H,5H2,1H3,(H,10,12,14).
What are the key properties of N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide?
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide has a molecular weight of 223.26 g/mol, XLogP of 0.68, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 39723877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).