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

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Related Compounds

N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 30246197
N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;molecular hydrogen
CID 162747394
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 1250957
2-(2-methylindol-1-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 17460159
ethyl 4-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]piperazine-1-carboxylate
CID 17066457
N-(4-oxo-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-c]azepin-2-yl)-2-pyrazol-1-ylacetamide
CID 72719997
2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 22195848
2-(4-fluorophenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 808377
2-[5-(hydroxymethyl)triazol-1-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 82210964
dimethyl-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]azanium
CID 6965716
2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 6458214
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 1096304

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).