2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide

C13H11N5OS — CID 29370870

IUPAC2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(Cc1cnn(-c2ccccc2)c1)Nc1nncs1
InChIInChI=1S/C13H11N5OS/c19-12(16-13-17-14-9-20-13)6-10-7-15-18(8-10)11-4-2-1-3-5-11/h1-5,7-9H,6H2,(H,16,17,19)
InChIKeyGAGASDVYJSXCGH-UHFFFAOYSA-N
MW285.33 g/mol
LogP1.90
Rot. Bonds4

About 2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide

2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 29370870) has the molecular formula C13H11N5OS and a molecular weight of 285.33 g/mol. Its IUPAC name is 2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide
PubChem CID29370870
Molecular FormulaC13H11N5OS
Molecular Weight285.33 g/mol
Exact Mass285.07
IUPAC Name2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(Cc1cnn(-c2ccccc2)c1)Nc1nncs1
InChIInChI=1S/C13H11N5OS/c19-12(16-13-17-14-9-20-13)6-10-7-15-18(8-10)11-4-2-1-3-5-11/h1-5,7-9H,6H2,(H,16,17,19)
InChIKeyGAGASDVYJSXCGH-UHFFFAOYSA-N
XLogP1.90
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-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

Related Compounds

N-[(1-phenylpyrazol-4-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 103746202
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(1-phenylpyrazol-4-yl)acetamide
CID 16622498
N-(1,3-benzothiazol-2-yl)-2-(1-phenylpyrazol-4-yl)acetamide
CID 16614963
2-(1-phenylpyrazol-4-yl)-N-pyridin-4-ylacetamide
CID 18152814
N'-acetyl-2-(1-phenylpyrazol-4-yl)acetohydrazide
CID 30905613
N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2-(1-phenylpyrazol-4-yl)acetamide
CID 16621598
2-phenyl-2-[[2-(1-phenylpyrazol-4-yl)acetyl]amino]acetamide
CID 51336196
1-[3-(1-phenylpyrazol-4-yl)propanoyl]-N-(1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide
CID 47049899
N-(4-acetylphenyl)-2-(1-phenylpyrazol-4-yl)acetamide
CID 16620682
2-oxo-3-(1-phenylpyrazol-4-yl)propanoic acid
CID 16787671
N-(6-methyl-1,3-benzothiazol-2-yl)-2-(1-phenylpyrazol-4-yl)acetamide
CID 16614958
N-tert-butyl-2-(1-phenylpyrazol-4-yl)acetamide
CID 47141475

Frequently Asked Questions

What is the IUPAC name of 2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide (CID 29370870) is 2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide is O=C(Cc1cnn(-c2ccccc2)c1)Nc1nncs1.
What is the InChIKey of 2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is GAGASDVYJSXCGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5OS/c19-12(16-13-17-14-9-20-13)6-10-7-15-18(8-10)11-4-2-1-3-5-11/h1-5,7-9H,6H2,(H,16,17,19).
What are the key properties of 2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide?
2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 285.33 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-phenylpyrazol-4-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 29370870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).