N-(2-methylpyrazol-3-yl)benzenesulfonamide

C10H11N3O2S — CID 2808912

IUPACN-(2-methylpyrazol-3-yl)benzenesulfonamide
SMILESCn1nccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C10H11N3O2S/c1-13-10(7-8-11-13)12-16(14,15)9-5-3-2-4-6-9/h2-8,12H,1H3
InChIKeyZCUMVNZLSAFCJS-UHFFFAOYSA-N
MW237.28 g/mol
LogP1.22
Rot. Bonds3

About N-(2-methylpyrazol-3-yl)benzenesulfonamide

N-(2-methylpyrazol-3-yl)benzenesulfonamide (PubChem CID 2808912) has the molecular formula C10H11N3O2S and a molecular weight of 237.28 g/mol. Its IUPAC name is N-(2-methylpyrazol-3-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-methylpyrazol-3-yl)benzenesulfonamide
PubChem CID2808912
Molecular FormulaC10H11N3O2S
Molecular Weight237.28 g/mol
Exact Mass237.06
IUPAC NameN-(2-methylpyrazol-3-yl)benzenesulfonamide
SMILESCn1nccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C10H11N3O2S/c1-13-10(7-8-11-13)12-16(14,15)9-5-3-2-4-6-9/h2-8,12H,1H3
InChIKeyZCUMVNZLSAFCJS-UHFFFAOYSA-N
XLogP1.22
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpyrazol-3-yl)benzenesulfonamide?
The IUPAC name of N-(2-methylpyrazol-3-yl)benzenesulfonamide (CID 2808912) is N-(2-methylpyrazol-3-yl)benzenesulfonamide.
What is the SMILES notation for N-(2-methylpyrazol-3-yl)benzenesulfonamide?
The canonical SMILES for N-(2-methylpyrazol-3-yl)benzenesulfonamide is Cn1nccc1NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-(2-methylpyrazol-3-yl)benzenesulfonamide?
The InChIKey is ZCUMVNZLSAFCJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2S/c1-13-10(7-8-11-13)12-16(14,15)9-5-3-2-4-6-9/h2-8,12H,1H3.
What are the key properties of N-(2-methylpyrazol-3-yl)benzenesulfonamide?
N-(2-methylpyrazol-3-yl)benzenesulfonamide has a molecular weight of 237.28 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpyrazol-3-yl)benzenesulfonamide is sourced from PubChem (CID 2808912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).