2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide

C6H14N2O4S — CID 59950844

IUPAC2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide
SMILESCCS(=O)(=O)N(C)C(C)C(=O)NO
InChIInChI=1S/C6H14N2O4S/c1-4-13(11,12)8(3)5(2)6(9)7-10/h5,10H,4H2,1-3H3,(H,7,9)
InChIKeyDACYGGPSJNGFDQ-UHFFFAOYSA-N
MW210.25 g/mol
LogP-0.84
Rot. Bonds4

About 2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide

2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide (PubChem CID 59950844) has the molecular formula C6H14N2O4S and a molecular weight of 210.25 g/mol. Its IUPAC name is 2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide.

Molecular Properties

Compound Name2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide
PubChem CID59950844
Molecular FormulaC6H14N2O4S
Molecular Weight210.25 g/mol
Exact Mass210.07
IUPAC Name2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide
SMILESCCS(=O)(=O)N(C)C(C)C(=O)NO
InChIInChI=1S/C6H14N2O4S/c1-4-13(11,12)8(3)5(2)6(9)7-10/h5,10H,4H2,1-3H3,(H,7,9)
InChIKeyDACYGGPSJNGFDQ-UHFFFAOYSA-N
XLogP-0.84
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 5-0.84
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

2-[acetyl(methyl)amino]-N-hydroxypropanamide
CID 20680996
N-[1-(hydroxyamino)-1-oxopropan-2-yl]-N,2-dimethylpropanamide
CID 18729408
2-[4-[ethylsulfonyl(methyl)amino]phenyl]-N-hydroxy-2-phenylacetamide
CID 87443868
2-[methyl(2-methylsulfonylethylsulfonyl)amino]propanoic acid
CID 63245003
(2S)-2-amino-N-[2-(dimethylsulfamoyl)ethyl]propanamide
CID 106337421
N,N-di(propan-2-yl)ethanesulfonamide
CID 3289511
(2R)-2-[butylsulfonyl(methylcarbamoyl)amino]propanoic acid
CID 87782830
(2S)-2-amino-N-[3-[ethylsulfonyl(methyl)amino]propyl]propanamide;hydrochloride
CID 119292329
2-(dimethylamino)-N-octadecylpropanamide
CID 161206779
3-amino-N-[2-(dimethylsulfamoyl)ethyl]-2-methylbutanamide
CID 106337551
2-bromo-N-[2-(dimethylsulfamoyl)ethyl]-3-methylbutanamide
CID 106335483
2-[[2-[ethylsulfonyl(methyl)amino]acetyl]amino]propanoic acid
CID 119348539

Frequently Asked Questions

What is the IUPAC name of 2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide?
The IUPAC name of 2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide (CID 59950844) is 2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide.
What is the SMILES notation for 2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide?
The canonical SMILES for 2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide is CCS(=O)(=O)N(C)C(C)C(=O)NO.
What is the InChIKey of 2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide?
The InChIKey is DACYGGPSJNGFDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O4S/c1-4-13(11,12)8(3)5(2)6(9)7-10/h5,10H,4H2,1-3H3,(H,7,9).
What are the key properties of 2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide?
2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide has a molecular weight of 210.25 g/mol, XLogP of -0.84, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide is sourced from PubChem (CID 59950844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).