N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide

C11H15N5O2S — CID 43543964

IUPACN-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide
SMILESCCn1cc(NS(=O)(=O)c2ccc(NN)cc2)cn1
InChIInChI=1S/C11H15N5O2S/c1-2-16-8-10(7-13-16)15-19(17,18)11-5-3-9(14-12)4-6-11/h3-8,14-15H,2,12H2,1H3
InChIKeySQOKPSOTXVMYBK-UHFFFAOYSA-N
MW281.34 g/mol
LogP0.99
Rot. Bonds5

About N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide

N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide (PubChem CID 43543964) has the molecular formula C11H15N5O2S and a molecular weight of 281.34 g/mol. Its IUPAC name is N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide.

Molecular Properties

Compound NameN-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide
PubChem CID43543964
Molecular FormulaC11H15N5O2S
Molecular Weight281.34 g/mol
Exact Mass281.09
IUPAC NameN-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide
SMILESCCn1cc(NS(=O)(=O)c2ccc(NN)cc2)cn1
InChIInChI=1S/C11H15N5O2S/c1-2-16-8-10(7-13-16)15-19(17,18)11-5-3-9(14-12)4-6-11/h3-8,14-15H,2,12H2,1H3
InChIKeySQOKPSOTXVMYBK-UHFFFAOYSA-N
XLogP0.99
TPSA102.04 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(1-ethylpyrazol-4-yl)-4-(methylaminomethyl)benzenesulfonamide
CID 60824964
4-[(1-ethylpyrazol-4-yl)sulfamoyl]benzoic acid
CID 43430297
6-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide
CID 39836918
1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide
CID 22203400
3-bromo-N-(1-ethylpyrazol-4-yl)-4-fluorobenzenesulfonamide
CID 71991658
3-(aminomethyl)-N-(1-ethylpyrazol-4-yl)-4-fluorobenzenesulfonamide
CID 63287880
3-amino-N-(1-ethylpyrazol-4-yl)-4,5-dimethylbenzenesulfonamide
CID 43543231
N-(1-ethylpyrazol-4-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
CID 31913122
2-[4-[(1-ethylpyrazol-4-yl)sulfamoyl]pyrazol-1-yl]acetic acid
CID 43543582
N-[5-[(1-ethylpyrazol-4-yl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 31913130
4-fluoro-N-[1-(2-methylpropyl)pyrazol-4-yl]benzenesulfonamide
CID 71991616
1-ethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyrazole-4-sulfonamide
CID 19684607

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide?
The IUPAC name of N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide (CID 43543964) is N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide.
What is the SMILES notation for N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide?
The canonical SMILES for N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide is CCn1cc(NS(=O)(=O)c2ccc(NN)cc2)cn1.
What is the InChIKey of N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide?
The InChIKey is SQOKPSOTXVMYBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2S/c1-2-16-8-10(7-13-16)15-19(17,18)11-5-3-9(14-12)4-6-11/h3-8,14-15H,2,12H2,1H3.
What are the key properties of N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide?
N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide has a molecular weight of 281.34 g/mol, XLogP of 0.99, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide is sourced from PubChem (CID 43543964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).