N-pyridazin-3-ylmethanesulfonamide

C5H7N3O2S — CID 58905431

IUPACN-pyridazin-3-ylmethanesulfonamide
SMILESCS(=O)(=O)Nc1cccnn1
InChIInChI=1S/C5H7N3O2S/c1-11(9,10)8-5-3-2-4-6-7-5/h2-4H,1H3,(H,7,8)
InChIKeyUOJBGSQEIVGDDZ-UHFFFAOYSA-N
MW173.20 g/mol
LogP-0.15
Rot. Bonds2

About N-pyridazin-3-ylmethanesulfonamide

N-pyridazin-3-ylmethanesulfonamide (PubChem CID 58905431) has the molecular formula C5H7N3O2S and a molecular weight of 173.20 g/mol. Its IUPAC name is N-pyridazin-3-ylmethanesulfonamide.

Molecular Properties

Compound NameN-pyridazin-3-ylmethanesulfonamide
PubChem CID58905431
Molecular FormulaC5H7N3O2S
Molecular Weight173.20 g/mol
Exact Mass173.03
IUPAC NameN-pyridazin-3-ylmethanesulfonamide
SMILESCS(=O)(=O)Nc1cccnn1
InChIInChI=1S/C5H7N3O2S/c1-11(9,10)8-5-3-2-4-6-7-5/h2-4H,1H3,(H,7,8)
InChIKeyUOJBGSQEIVGDDZ-UHFFFAOYSA-N
XLogP-0.15
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.20
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-pyridazin-3-ylmethanesulfonamide?
The IUPAC name of N-pyridazin-3-ylmethanesulfonamide (CID 58905431) is N-pyridazin-3-ylmethanesulfonamide.
What is the SMILES notation for N-pyridazin-3-ylmethanesulfonamide?
The canonical SMILES for N-pyridazin-3-ylmethanesulfonamide is CS(=O)(=O)Nc1cccnn1.
What is the InChIKey of N-pyridazin-3-ylmethanesulfonamide?
The InChIKey is UOJBGSQEIVGDDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O2S/c1-11(9,10)8-5-3-2-4-6-7-5/h2-4H,1H3,(H,7,8).
What are the key properties of N-pyridazin-3-ylmethanesulfonamide?
N-pyridazin-3-ylmethanesulfonamide has a molecular weight of 173.20 g/mol, XLogP of -0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridazin-3-ylmethanesulfonamide is sourced from PubChem (CID 58905431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).