N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide

C14H13NO5S — CID 11616500

IUPACN-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide
SMILESO=C(CS(=O)(=O)c1ccc(Oc2ccccc2)cc1)NO
InChIInChI=1S/C14H13NO5S/c16-14(15-17)10-21(18,19)13-8-6-12(7-9-13)20-11-4-2-1-3-5-11/h1-9,17H,10H2,(H,15,16)
InChIKeyVFZUVETVSPJFEB-UHFFFAOYSA-N
MW307.33 g/mol
LogP1.76
Rot. Bonds5

About N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide

N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide (PubChem CID 11616500) has the molecular formula C14H13NO5S and a molecular weight of 307.33 g/mol. Its IUPAC name is N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide.

Molecular Properties

Compound NameN-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide
PubChem CID11616500
Molecular FormulaC14H13NO5S
Molecular Weight307.33 g/mol
Exact Mass307.05
IUPAC NameN-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide
SMILESO=C(CS(=O)(=O)c1ccc(Oc2ccccc2)cc1)NO
InChIInChI=1S/C14H13NO5S/c16-14(15-17)10-21(18,19)13-8-6-12(7-9-13)20-11-4-2-1-3-5-11/h1-9,17H,10H2,(H,15,16)
InChIKeyVFZUVETVSPJFEB-UHFFFAOYSA-N
XLogP1.76
TPSA92.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.33
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

2-(benzenesulfonyl)-N-hydroxyacetamide
CID 91245592
2-[4-[4-(carboxymethylsulfonyl)phenoxy]phenyl]sulfonylacetic acid
CID 656313
N-hydroxy-2-methyl-4-(4-phenoxyphenyl)sulfonylbutanamide
CID 12968522
2-amino-N-hydroxy-3-(4-phenoxyphenyl)sulfonyl-2-phenylpropanamide
CID 21130554
2-(4-methoxyphenyl)sulfonyl-N-phenylacetamide
CID 15451751
2-amino-N-hydroxy-3,3-dimethyl-4-(4-phenoxyphenyl)sulfonylbutanamide;hydrochloride
CID 18406833
(2R)-2-[acetyl(methyl)amino]-N-hydroxy-3-(4-phenoxyphenyl)sulfonylpropanamide
CID 11741226
4-(hydroxycarbamoyl)-4-[2-(4-phenoxyphenyl)sulfonylethyl]piperidine-1-carboxylic acid
CID 18406831
N-[(2R)-1-(hydroxyamino)-1-oxo-3-(4-phenoxyphenyl)sulfonylpropan-2-yl]pyridine-4-carboxamide
CID 59071623
3-(benzenesulfonyl)-2-oxopropanoic acid
CID 91929914
N-[(2R)-1-(hydroxyamino)-1-oxo-3-(4-phenoxyphenyl)sulfonylpropan-2-yl]-2,6-dimethoxybenzamide
CID 59071627
3-(4-ethylsulfonylphenoxy)benzoic acid
CID 61395541

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide?
The IUPAC name of N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide (CID 11616500) is N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide.
What is the SMILES notation for N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide?
The canonical SMILES for N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide is O=C(CS(=O)(=O)c1ccc(Oc2ccccc2)cc1)NO.
What is the InChIKey of N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide?
The InChIKey is VFZUVETVSPJFEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO5S/c16-14(15-17)10-21(18,19)13-8-6-12(7-9-13)20-11-4-2-1-3-5-11/h1-9,17H,10H2,(H,15,16).
What are the key properties of N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide?
N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide has a molecular weight of 307.33 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-(4-phenoxyphenyl)sulfonylacetamide is sourced from PubChem (CID 11616500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).