N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide

C7H16N2O4S — CID 103306916

IUPACN-ethylsulfonyl-2-(2-methoxyethylamino)acetamide
SMILESCCS(=O)(=O)NC(=O)CNCCOC
InChIInChI=1S/C7H16N2O4S/c1-3-14(11,12)9-7(10)6-8-4-5-13-2/h8H,3-6H2,1-2H3,(H,9,10)
InChIKeyXPQLOOBMYCTOQE-UHFFFAOYSA-N
MW224.28 g/mol
LogP-1.31
Rot. Bonds7

About N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide

N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide (PubChem CID 103306916) has the molecular formula C7H16N2O4S and a molecular weight of 224.28 g/mol. Its IUPAC name is N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide.

Molecular Properties

Compound NameN-ethylsulfonyl-2-(2-methoxyethylamino)acetamide
PubChem CID103306916
Molecular FormulaC7H16N2O4S
Molecular Weight224.28 g/mol
Exact Mass224.08
IUPAC NameN-ethylsulfonyl-2-(2-methoxyethylamino)acetamide
SMILESCCS(=O)(=O)NC(=O)CNCCOC
InChIInChI=1S/C7H16N2O4S/c1-3-14(11,12)9-7(10)6-8-4-5-13-2/h8H,3-6H2,1-2H3,(H,9,10)
InChIKeyXPQLOOBMYCTOQE-UHFFFAOYSA-N
XLogP-1.31
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 5-1.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyethylamino)-N-methylsulfonylacetamide
CID 103287494
N-cyclopropylsulfonyl-2-(2-methoxyethylamino)acetamide
CID 103308426
N-ethyl-2-(2-methoxyethylamino)acetamide
CID 28565523
N-hydroxy-2-(2-methoxyethylamino)acetamide
CID 79282707
N-[4-(ethylsulfonylamino)phenyl]-2-(2-methoxyethylamino)acetamide
CID 79272393
2-(2-methoxyethylamino)-N-(2-sulfamoylethyl)acetamide
CID 79281474
2-(2-methoxyethylamino)-N-(3-methoxypropyl)acetamide;hydrochloride
CID 119672351
ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate
CID 79282629
N-(2-methoxyethyl)-2-(2-propoxyethylamino)acetamide
CID 106452448
2-(2-methoxyethylamino)-N-[4-(propylsulfonylamino)phenyl]acetamide;hydrochloride
CID 119754250
2-(2-methoxyethylamino)-N-(2-methylpentan-2-yl)acetamide
CID 115738896
2-(ethylsulfonylamino)-N-[2-(2-methoxyethylamino)ethyl]ethanesulfonamide
CID 120717495

Frequently Asked Questions

What is the IUPAC name of N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide?
The IUPAC name of N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide (CID 103306916) is N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide.
What is the SMILES notation for N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide?
The canonical SMILES for N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide is CCS(=O)(=O)NC(=O)CNCCOC.
What is the InChIKey of N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide?
The InChIKey is XPQLOOBMYCTOQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O4S/c1-3-14(11,12)9-7(10)6-8-4-5-13-2/h8H,3-6H2,1-2H3,(H,9,10).
What are the key properties of N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide?
N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide has a molecular weight of 224.28 g/mol, XLogP of -1.31, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylsulfonyl-2-(2-methoxyethylamino)acetamide is sourced from PubChem (CID 103306916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).