benzenesulfonamide;1H-pyrazole

C9H11N3O2S — CID 18676099

IUPACbenzenesulfonamide;1H-pyrazole
SMILESNS(=O)(=O)c1ccccc1.c1cn[nH]c1
InChIInChI=1S/C6H7NO2S.C3H4N2/c7-10(8,9)6-4-2-1-3-5-6;1-2-4-5-3-1/h1-5H,(H2,7,8,9);1-3H,(H,4,5)
InChIKeyHGMSPMSKURFMGH-UHFFFAOYSA-N
MW225.27 g/mol
LogP0.74
Rot. Bonds1

About benzenesulfonamide;1H-pyrazole

benzenesulfonamide;1H-pyrazole (PubChem CID 18676099) has the molecular formula C9H11N3O2S and a molecular weight of 225.27 g/mol. Its IUPAC name is benzenesulfonamide;1H-pyrazole.

Molecular Properties

Compound Namebenzenesulfonamide;1H-pyrazole
PubChem CID18676099
Molecular FormulaC9H11N3O2S
Molecular Weight225.27 g/mol
Exact Mass225.06
IUPAC Namebenzenesulfonamide;1H-pyrazole
SMILESNS(=O)(=O)c1ccccc1.c1cn[nH]c1
InChIInChI=1S/C6H7NO2S.C3H4N2/c7-10(8,9)6-4-2-1-3-5-6;1-2-4-5-3-1/h1-5H,(H2,7,8,9);1-3H,(H,4,5)
InChIKeyHGMSPMSKURFMGH-UHFFFAOYSA-N
XLogP0.74
TPSA88.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Benzenesulfonylpyrazole
CID 588934
4-(benzenesulfonyl)-1H-pyrazole
CID 15880400
3-methyl-1-(phenylsulfonyl)-1H-pyrazole
CID 2992104
(Phenylthio)pyrazole
CID 4307621
1-[(4-fluorophenyl)sulfonyl]-1H-pyrazole
CID 4657111
2-fluoro-N-(1H-pyrazol-4-yl)benzene-1-sulfonamide
CID 43532703
5-(benzenesulfonyl)-1H-pyrazole
CID 15880398
N-(1H-Pyrazol-5-yl)benzenesulfonamide
CID 21254985
1h-Pyrazol-1-yl benzenesulfonamide
CID 22315462
1-Phenylsulfanylpyrazole
CID 90711289
Pyrazolium tosylate
CID 129736735
1-(2,4,5-Trifluorophenyl)sulfonylpyrazole
CID 89544349

Frequently Asked Questions

What is the IUPAC name of benzenesulfonamide;1H-pyrazole?
The IUPAC name of benzenesulfonamide;1H-pyrazole (CID 18676099) is benzenesulfonamide;1H-pyrazole.
What is the SMILES notation for benzenesulfonamide;1H-pyrazole?
The canonical SMILES for benzenesulfonamide;1H-pyrazole is NS(=O)(=O)c1ccccc1.c1cn[nH]c1.
What is the InChIKey of benzenesulfonamide;1H-pyrazole?
The InChIKey is HGMSPMSKURFMGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO2S.C3H4N2/c7-10(8,9)6-4-2-1-3-5-6;1-2-4-5-3-1/h1-5H,(H2,7,8,9);1-3H,(H,4,5).
What are the key properties of benzenesulfonamide;1H-pyrazole?
benzenesulfonamide;1H-pyrazole has a molecular weight of 225.27 g/mol, XLogP of 0.74, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzenesulfonamide;1H-pyrazole is sourced from PubChem (CID 18676099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).