2-(benzenesulfonyl)-N-hydroxyacetamide

C8H9NO4S — CID 91245592

IUPAC2-(benzenesulfonyl)-N-hydroxyacetamide
SMILESO=C(CS(=O)(=O)c1ccccc1)NO
InChIInChI=1S/C8H9NO4S/c10-8(9-11)6-14(12,13)7-4-2-1-3-5-7/h1-5,11H,6H2,(H,9,10)
InChIKeyPSDWIIOEHCSHIT-UHFFFAOYSA-N
MW215.23 g/mol
LogP-0.03
Rot. Bonds3

About 2-(benzenesulfonyl)-N-hydroxyacetamide

2-(benzenesulfonyl)-N-hydroxyacetamide (PubChem CID 91245592) has the molecular formula C8H9NO4S and a molecular weight of 215.23 g/mol. Its IUPAC name is 2-(benzenesulfonyl)-N-hydroxyacetamide.

Molecular Properties

Compound Name2-(benzenesulfonyl)-N-hydroxyacetamide
PubChem CID91245592
Molecular FormulaC8H9NO4S
Molecular Weight215.23 g/mol
Exact Mass215.03
IUPAC Name2-(benzenesulfonyl)-N-hydroxyacetamide
SMILESO=C(CS(=O)(=O)c1ccccc1)NO
InChIInChI=1S/C8H9NO4S/c10-8(9-11)6-14(12,13)7-4-2-1-3-5-7/h1-5,11H,6H2,(H,9,10)
InChIKeyPSDWIIOEHCSHIT-UHFFFAOYSA-N
XLogP-0.03
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.23
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide
CID 11616500
2-(benzenesulfonyl)-N-propylacetamide
CID 4683894
3-(benzenesulfonyl)-2-oxopropanoic acid
CID 91929914
methyl 2-[[2-(benzenesulfonyl)acetyl]amino]acetate
CID 17257191
N-(4-aminophenyl)-2-(benzenesulfonyl)acetamide
CID 43444150
N-(2-aminophenyl)-2-(benzenesulfonyl)acetamide
CID 43444147
2-(benzenesulfonyl)-N-(2-methoxyethyl)acetamide
CID 4669568
2-(benzenesulfonyl)-N-[(4-fluorophenyl)methyl]acetamide
CID 78761130
2-(benzenesulfonylmethyl)prop-2-enoic acid
CID 14296318
1-(benzenesulfonyl)-3-chloropropan-2-one
CID 555621
N-[2-(benzenesulfonyl)ethyl]-2-(4-chlorophenyl)sulfonylacetamide
CID 2765509
2-(benzenesulfonyl)-N-(2-propan-2-ylphenyl)acetamide
CID 2992103

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonyl)-N-hydroxyacetamide?
The IUPAC name of 2-(benzenesulfonyl)-N-hydroxyacetamide (CID 91245592) is 2-(benzenesulfonyl)-N-hydroxyacetamide.
What is the SMILES notation for 2-(benzenesulfonyl)-N-hydroxyacetamide?
The canonical SMILES for 2-(benzenesulfonyl)-N-hydroxyacetamide is O=C(CS(=O)(=O)c1ccccc1)NO.
What is the InChIKey of 2-(benzenesulfonyl)-N-hydroxyacetamide?
The InChIKey is PSDWIIOEHCSHIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO4S/c10-8(9-11)6-14(12,13)7-4-2-1-3-5-7/h1-5,11H,6H2,(H,9,10).
What are the key properties of 2-(benzenesulfonyl)-N-hydroxyacetamide?
2-(benzenesulfonyl)-N-hydroxyacetamide has a molecular weight of 215.23 g/mol, XLogP of -0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonyl)-N-hydroxyacetamide is sourced from PubChem (CID 91245592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).