2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide

C17H20N2O4S — CID 87443868

IUPAC2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide
SMILESCCS(=O)(=O)N(C)c1ccc(C(C(=O)NO)c2ccccc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-3-24(22,23)19(2)15-11-9-14(10-12-15)16(17(20)18-21)13-7-5-4-6-8-13/h4-12,16,21H,3H2,1-2H3,(H,18,20)
InChIKeyNQQGSXWJBWAWQV-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.11
Rot. Bonds6

About 2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide

2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide (PubChem CID 87443868) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide.

Molecular Properties

Compound Name2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide
PubChem CID87443868
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide
SMILESCCS(=O)(=O)N(C)c1ccc(C(C(=O)NO)c2ccccc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-3-24(22,23)19(2)15-11-9-14(10-12-15)16(17(20)18-21)13-7-5-4-6-8-13/h4-12,16,21H,3H2,1-2H3,(H,18,20)
InChIKeyNQQGSXWJBWAWQV-UHFFFAOYSA-N
XLogP2.11
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.11
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-benzhydryl-3-[ethylsulfonyl(methyl)amino]benzamide
CID 100786033
N-[4-[2-(hydroxyamino)-2-oxo-1-phenylethyl]phenyl]-2,2-dimethylbutanamide
CID 87444428
N-[4-(dimethylamino)phenyl]-N-methylethanesulfonamide
CID 86816575
N-hydroxy-2-[4-[4-(methoxymethyl)phenyl]phenyl]-2-phenylacetamide
CID 135320572
N-benzyl-4-[ethylsulfonyl(methyl)amino]-N-methylbenzamide
CID 8991375
N-butan-2-yl-2,2-diphenylacetamide
CID 3094060
N,N-dimethyl-2,2-diphenylacetamide
CID 19693860
2-[methyl(phenyl)sulfamoyl]acetic acid
CID 28773465
N-(3-bromophenyl)-4-[ethylsulfonyl(methyl)amino]benzamide
CID 8991381
4-[ethylsulfonyl(methyl)amino]-N-[(2R)-pentan-2-yl]benzamide
CID 27211679
2-[3-[3-(dimethylamino)propoxy]phenyl]-N-hydroxy-2-phenylacetamide
CID 25155089
(2,2-diphenylacetyl)-methylsulfamic acid
CID 174462025

Frequently Asked Questions

What is the IUPAC name of 2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide?
The IUPAC name of 2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide (CID 87443868) is 2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide.
What is the SMILES notation for 2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide?
The canonical SMILES for 2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide is CCS(=O)(=O)N(C)c1ccc(C(C(=O)NO)c2ccccc2)cc1.
What is the InChIKey of 2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide?
The InChIKey is NQQGSXWJBWAWQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-3-24(22,23)19(2)15-11-9-14(10-12-15)16(17(20)18-21)13-7-5-4-6-8-13/h4-12,16,21H,3H2,1-2H3,(H,18,20).
What are the key properties of 2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide?
2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide has a molecular weight of 348.42 g/mol, XLogP of 2.11, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide is sourced from PubChem (CID 87443868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).