2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole

C8H9N3O2S — CID 67378339

IUPAC2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole
SMILESO=S(=O)(C1CC1)n1cc2c(n1)CN=C2
InChIInChI=1S/C8H9N3O2S/c12-14(13,7-1-2-7)11-5-6-3-9-4-8(6)10-11/h3,5,7H,1-2,4H2
InChIKeyGCVPVFGIAWBONC-UHFFFAOYSA-N
MW211.25 g/mol
LogP0.16
Rot. Bonds2

About 2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole

2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole (PubChem CID 67378339) has the molecular formula C8H9N3O2S and a molecular weight of 211.25 g/mol. Its IUPAC name is 2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole.

Molecular Properties

Compound Name2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole
PubChem CID67378339
Molecular FormulaC8H9N3O2S
Molecular Weight211.25 g/mol
Exact Mass211.04
IUPAC Name2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole
SMILESO=S(=O)(C1CC1)n1cc2c(n1)CN=C2
InChIInChI=1S/C8H9N3O2S/c12-14(13,7-1-2-7)11-5-6-3-9-4-8(6)10-11/h3,5,7H,1-2,4H2
InChIKeyGCVPVFGIAWBONC-UHFFFAOYSA-N
XLogP0.16
TPSA64.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.25
LogP ≤ 50.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]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 2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole?
The IUPAC name of 2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole (CID 67378339) is 2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole.
What is the SMILES notation for 2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole?
The canonical SMILES for 2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole is O=S(=O)(C1CC1)n1cc2c(n1)CN=C2.
What is the InChIKey of 2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole?
The InChIKey is GCVPVFGIAWBONC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O2S/c12-14(13,7-1-2-7)11-5-6-3-9-4-8(6)10-11/h3,5,7H,1-2,4H2.
What are the key properties of 2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole?
2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole has a molecular weight of 211.25 g/mol, XLogP of 0.16, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropylsulfonyl-6H-pyrrolo[3,4-c]pyrazole is sourced from PubChem (CID 67378339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).