2-pyrazol-1-yl-1,3-thiazole

C6H5N3S — CID 14387157

IUPAC2-pyrazol-1-yl-1,3-thiazole
SMILESc1cnn(-c2nccs2)c1
InChIInChI=1S/C6H5N3S/c1-2-8-9(4-1)6-7-3-5-10-6/h1-5H
InChIKeyFEMRJHRHQBPLPI-UHFFFAOYSA-N
MW151.19 g/mol
LogP1.33
Rot. Bonds1

About 2-pyrazol-1-yl-1,3-thiazole

2-pyrazol-1-yl-1,3-thiazole (PubChem CID 14387157) has the molecular formula C6H5N3S and a molecular weight of 151.19 g/mol. Its IUPAC name is 2-pyrazol-1-yl-1,3-thiazole.

Molecular Properties

Compound Name2-pyrazol-1-yl-1,3-thiazole
PubChem CID14387157
Molecular FormulaC6H5N3S
Molecular Weight151.19 g/mol
Exact Mass151.02
IUPAC Name2-pyrazol-1-yl-1,3-thiazole
SMILESc1cnn(-c2nccs2)c1
InChIInChI=1S/C6H5N3S/c1-2-8-9(4-1)6-7-3-5-10-6/h1-5H
InChIKeyFEMRJHRHQBPLPI-UHFFFAOYSA-N
XLogP1.33
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.19
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-pyrazol-1-yl-1,3-thiazole 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-pyrazol-1-yl-1,3-thiazole?
The IUPAC name of 2-pyrazol-1-yl-1,3-thiazole (CID 14387157) is 2-pyrazol-1-yl-1,3-thiazole.
What is the SMILES notation for 2-pyrazol-1-yl-1,3-thiazole?
The canonical SMILES for 2-pyrazol-1-yl-1,3-thiazole is c1cnn(-c2nccs2)c1.
What is the InChIKey of 2-pyrazol-1-yl-1,3-thiazole?
The InChIKey is FEMRJHRHQBPLPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3S/c1-2-8-9(4-1)6-7-3-5-10-6/h1-5H.
What are the key properties of 2-pyrazol-1-yl-1,3-thiazole?
2-pyrazol-1-yl-1,3-thiazole has a molecular weight of 151.19 g/mol, XLogP of 1.33, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazol-1-yl-1,3-thiazole is sourced from PubChem (CID 14387157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).