1,3-dimethylthieno[3,2-d]pyrazole

C7H8N2S — CID 58425691

IUPAC1,3-dimethylthieno[3,2-d]pyrazole
SMILESCc1nn(C)c2sccc12
InChIInChI=1S/C7H8N2S/c1-5-6-3-4-10-7(6)9(2)8-5/h3-4H,1-2H3
InChIKeyUJZNUYYGAXKIIJ-UHFFFAOYSA-N
MW152.22 g/mol
LogP1.94
Rot. Bonds

About 1,3-dimethylthieno[3,2-d]pyrazole

1,3-dimethylthieno[3,2-d]pyrazole (PubChem CID 58425691) has the molecular formula C7H8N2S and a molecular weight of 152.22 g/mol. Its IUPAC name is 1,3-dimethylthieno[3,2-d]pyrazole.

Molecular Properties

Compound Name1,3-dimethylthieno[3,2-d]pyrazole
PubChem CID58425691
Molecular FormulaC7H8N2S
Molecular Weight152.22 g/mol
Exact Mass152.04
IUPAC Name1,3-dimethylthieno[3,2-d]pyrazole
SMILESCc1nn(C)c2sccc12
InChIInChI=1S/C7H8N2S/c1-5-6-3-4-10-7(6)9(2)8-5/h3-4H,1-2H3
InChIKeyUJZNUYYGAXKIIJ-UHFFFAOYSA-N
XLogP1.94
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.22
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1,3-dimethylthieno[3,2-d]pyrazole 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 1,3-dimethylthieno[3,2-d]pyrazole?
The IUPAC name of 1,3-dimethylthieno[3,2-d]pyrazole (CID 58425691) is 1,3-dimethylthieno[3,2-d]pyrazole.
What is the SMILES notation for 1,3-dimethylthieno[3,2-d]pyrazole?
The canonical SMILES for 1,3-dimethylthieno[3,2-d]pyrazole is Cc1nn(C)c2sccc12.
What is the InChIKey of 1,3-dimethylthieno[3,2-d]pyrazole?
The InChIKey is UJZNUYYGAXKIIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2S/c1-5-6-3-4-10-7(6)9(2)8-5/h3-4H,1-2H3.
What are the key properties of 1,3-dimethylthieno[3,2-d]pyrazole?
1,3-dimethylthieno[3,2-d]pyrazole has a molecular weight of 152.22 g/mol, XLogP of 1.94, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethylthieno[3,2-d]pyrazole is sourced from PubChem (CID 58425691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).