4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide

C6H8N4O3S — CID 135240872

IUPAC4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide
SMILESNS(=O)(=O)c1cnn2c1C(=O)NCC2
InChIInChI=1S/C6H8N4O3S/c7-14(12,13)4-3-9-10-2-1-8-6(11)5(4)10/h3H,1-2H2,(H,8,11)(H2,7,12,13)
InChIKeyRNMXYISRXAJOIH-UHFFFAOYSA-N
MW216.22 g/mol
LogP-1.73
Rot. Bonds1

About 4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide

4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide (PubChem CID 135240872) has the molecular formula C6H8N4O3S and a molecular weight of 216.22 g/mol. Its IUPAC name is 4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide.

Molecular Properties

Compound Name4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide
PubChem CID135240872
Molecular FormulaC6H8N4O3S
Molecular Weight216.22 g/mol
Exact Mass216.03
IUPAC Name4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide
SMILESNS(=O)(=O)c1cnn2c1C(=O)NCC2
InChIInChI=1S/C6H8N4O3S/c7-14(12,13)4-3-9-10-2-1-8-6(11)5(4)10/h3H,1-2H2,(H,8,11)(H2,7,12,13)
InChIKeyRNMXYISRXAJOIH-UHFFFAOYSA-N
XLogP-1.73
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.22
LogP ≤ 5-1.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide?
The IUPAC name of 4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide (CID 135240872) is 4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide.
What is the SMILES notation for 4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide?
The canonical SMILES for 4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide is NS(=O)(=O)c1cnn2c1C(=O)NCC2.
What is the InChIKey of 4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide?
The InChIKey is RNMXYISRXAJOIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O3S/c7-14(12,13)4-3-9-10-2-1-8-6(11)5(4)10/h3H,1-2H2,(H,8,11)(H2,7,12,13).
What are the key properties of 4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide?
4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide has a molecular weight of 216.22 g/mol, XLogP of -1.73, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-sulfonamide is sourced from PubChem (CID 135240872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).