pyridazine-3-sulfonamide

C4H5N3O2S — CID 23076742

IUPACpyridazine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnn1
InChIInChI=1S/C4H5N3O2S/c5-10(8,9)4-2-1-3-6-7-4/h1-3H,(H2,5,8,9)
InChIKeyCLXNXKPFPIZSKE-UHFFFAOYSA-N
MW159.17 g/mol
LogP-0.88
Rot. Bonds1

About pyridazine-3-sulfonamide

pyridazine-3-sulfonamide (PubChem CID 23076742) has the molecular formula C4H5N3O2S and a molecular weight of 159.17 g/mol. Its IUPAC name is pyridazine-3-sulfonamide.

Molecular Properties

Compound Namepyridazine-3-sulfonamide
PubChem CID23076742
Molecular FormulaC4H5N3O2S
Molecular Weight159.17 g/mol
Exact Mass159.01
IUPAC Namepyridazine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnn1
InChIInChI=1S/C4H5N3O2S/c5-10(8,9)4-2-1-3-6-7-4/h1-3H,(H2,5,8,9)
InChIKeyCLXNXKPFPIZSKE-UHFFFAOYSA-N
XLogP-0.88
TPSA85.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.17
LogP ≤ 5-0.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of pyridazine-3-sulfonamide?
The IUPAC name of pyridazine-3-sulfonamide (CID 23076742) is pyridazine-3-sulfonamide.
What is the SMILES notation for pyridazine-3-sulfonamide?
The canonical SMILES for pyridazine-3-sulfonamide is NS(=O)(=O)c1cccnn1.
What is the InChIKey of pyridazine-3-sulfonamide?
The InChIKey is CLXNXKPFPIZSKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N3O2S/c5-10(8,9)4-2-1-3-6-7-4/h1-3H,(H2,5,8,9).
What are the key properties of pyridazine-3-sulfonamide?
pyridazine-3-sulfonamide has a molecular weight of 159.17 g/mol, XLogP of -0.88, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyridazine-3-sulfonamide is sourced from PubChem (CID 23076742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).