4-methyl-N-pyridazin-3-ylbenzenesulfonamide

C11H11N3O2S — CID 118115921

IUPAC4-methyl-N-pyridazin-3-ylbenzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2cccnn2)cc1
InChIInChI=1S/C11H11N3O2S/c1-9-4-6-10(7-5-9)17(15,16)14-11-3-2-8-12-13-11/h2-8H,1H3,(H,13,14)
InChIKeyQWNYXXODIVLUCP-UHFFFAOYSA-N
MW249.30 g/mol
LogP1.59
Rot. Bonds3

About 4-methyl-N-pyridazin-3-ylbenzenesulfonamide

4-methyl-N-pyridazin-3-ylbenzenesulfonamide (PubChem CID 118115921) has the molecular formula C11H11N3O2S and a molecular weight of 249.30 g/mol. Its IUPAC name is 4-methyl-N-pyridazin-3-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-methyl-N-pyridazin-3-ylbenzenesulfonamide
PubChem CID118115921
Molecular FormulaC11H11N3O2S
Molecular Weight249.30 g/mol
Exact Mass249.06
IUPAC Name4-methyl-N-pyridazin-3-ylbenzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2cccnn2)cc1
InChIInChI=1S/C11H11N3O2S/c1-9-4-6-10(7-5-9)17(15,16)14-11-3-2-8-12-13-11/h2-8H,1H3,(H,13,14)
InChIKeyQWNYXXODIVLUCP-UHFFFAOYSA-N
XLogP1.59
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.30
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-acetyl-N-pyridazin-3-ylbenzenesulfonamide
CID 116787283
4-nitro-N-pyridazin-3-ylbenzenesulfonamide
CID 127501672
6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787805
4-(3-hydroxyprop-1-ynyl)-N-pyridazin-3-ylbenzenesulfonamide
CID 116787673
6-(propylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787796
4-methyl-N-[2-[2-[(4-methylphenyl)sulfonylamino]phenyl]phenyl]benzenesulfonamide
CID 1010988
4-fluoro-3-(methylaminomethyl)-N-pyridazin-3-ylbenzenesulfonamide
CID 106084156
3,3-dimethyl-2-oxo-N-pyridazin-3-yl-1H-indole-5-sulfonamide
CID 167808491
N-[6-(benzylamino)pyridazin-3-yl]-4-methylbenzenesulfonamide
CID 16942022
4-methyl-N-[6-[(4-methylphenyl)methylamino]pyridazin-3-yl]benzenesulfonamide
CID 16942030
N-[6-(cyclopentylamino)pyridazin-3-yl]-4-methylbenzenesulfonamide
CID 16941993
5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide
CID 106084044

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-pyridazin-3-ylbenzenesulfonamide?
The IUPAC name of 4-methyl-N-pyridazin-3-ylbenzenesulfonamide (CID 118115921) is 4-methyl-N-pyridazin-3-ylbenzenesulfonamide.
What is the SMILES notation for 4-methyl-N-pyridazin-3-ylbenzenesulfonamide?
The canonical SMILES for 4-methyl-N-pyridazin-3-ylbenzenesulfonamide is Cc1ccc(S(=O)(=O)Nc2cccnn2)cc1.
What is the InChIKey of 4-methyl-N-pyridazin-3-ylbenzenesulfonamide?
The InChIKey is QWNYXXODIVLUCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2S/c1-9-4-6-10(7-5-9)17(15,16)14-11-3-2-8-12-13-11/h2-8H,1H3,(H,13,14).
What are the key properties of 4-methyl-N-pyridazin-3-ylbenzenesulfonamide?
4-methyl-N-pyridazin-3-ylbenzenesulfonamide has a molecular weight of 249.30 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-pyridazin-3-ylbenzenesulfonamide is sourced from PubChem (CID 118115921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).