5-pyrazol-1-yl-1,2,4-thiadiazole

C5H4N4S — CID 65277359

IUPAC5-pyrazol-1-yl-1,2,4-thiadiazole
SMILESc1cnn(-c2ncns2)c1
InChIInChI=1S/C5H4N4S/c1-2-7-9(3-1)5-6-4-8-10-5/h1-4H
InChIKeyQURCGJDNFRMSMS-UHFFFAOYSA-N
MW152.18 g/mol
LogP0.72
Rot. Bonds1

About 5-pyrazol-1-yl-1,2,4-thiadiazole

5-pyrazol-1-yl-1,2,4-thiadiazole (PubChem CID 65277359) has the molecular formula C5H4N4S and a molecular weight of 152.18 g/mol. Its IUPAC name is 5-pyrazol-1-yl-1,2,4-thiadiazole.

Molecular Properties

Compound Name5-pyrazol-1-yl-1,2,4-thiadiazole
PubChem CID65277359
Molecular FormulaC5H4N4S
Molecular Weight152.18 g/mol
Exact Mass152.02
IUPAC Name5-pyrazol-1-yl-1,2,4-thiadiazole
SMILESc1cnn(-c2ncns2)c1
InChIInChI=1S/C5H4N4S/c1-2-7-9(3-1)5-6-4-8-10-5/h1-4H
InChIKeyQURCGJDNFRMSMS-UHFFFAOYSA-N
XLogP0.72
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.18
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5-pyrazol-1-yl-1,2,4-thiadiazole 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

2-pyrazol-1-yl-1,3-thiazol-4-amine
CID 66520615
4-chloro-5-(chloromethyl)-6-pyrazol-1-ylpyrimidine
CID 107085658
5-methyl-6-pyrazol-1-ylpyrimidin-4-amine
CID 80853317
4-pyrazol-1-ylpyrido[2,3-d]pyrimidine
CID 110435911
4-(chloromethyl)-2-pyrazol-1-yl-1,3-thiazole
CID 71668962
4-ethenyl-2-pyrazol-1-yl-1,3-thiazole
CID 175746832
2-methyl-3-pyrazol-1-ylpyrazine
CID 83066223
1-[2,3,4-tri(pyrazol-1-yl)phenyl]pyrazole
CID 101467101
2,3-di(pyrazol-1-yl)pyridine
CID 91358877
ethane;2-methyl-3-pyrazol-1-ylpyrazine
CID 145106311
4-pyrazol-1-yl-6-(2,2,2-trifluoroethyl)pyrimidine
CID 173341974
4-(4-methylphenyl)-2-pyrazol-1-yl-1,3-thiazole
CID 14900464

Frequently Asked Questions

What is the IUPAC name of 5-pyrazol-1-yl-1,2,4-thiadiazole?
The IUPAC name of 5-pyrazol-1-yl-1,2,4-thiadiazole (CID 65277359) is 5-pyrazol-1-yl-1,2,4-thiadiazole.
What is the SMILES notation for 5-pyrazol-1-yl-1,2,4-thiadiazole?
The canonical SMILES for 5-pyrazol-1-yl-1,2,4-thiadiazole is c1cnn(-c2ncns2)c1.
What is the InChIKey of 5-pyrazol-1-yl-1,2,4-thiadiazole?
The InChIKey is QURCGJDNFRMSMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4N4S/c1-2-7-9(3-1)5-6-4-8-10-5/h1-4H.
What are the key properties of 5-pyrazol-1-yl-1,2,4-thiadiazole?
5-pyrazol-1-yl-1,2,4-thiadiazole has a molecular weight of 152.18 g/mol, XLogP of 0.72, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrazol-1-yl-1,2,4-thiadiazole is sourced from PubChem (CID 65277359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).