2-(2-methoxyethylamino)-N-methylsulfonylacetamide

C6H14N2O4S — CID 103287494

IUPAC2-(2-methoxyethylamino)-N-methylsulfonylacetamide
SMILESCOCCNCC(=O)NS(C)(=O)=O
InChIInChI=1S/C6H14N2O4S/c1-12-4-3-7-5-6(9)8-13(2,10)11/h7H,3-5H2,1-2H3,(H,8,9)
InChIKeyRTZKQANTMAMZFB-UHFFFAOYSA-N
MW210.25 g/mol
LogP-1.70
Rot. Bonds6

About 2-(2-methoxyethylamino)-N-methylsulfonylacetamide

2-(2-methoxyethylamino)-N-methylsulfonylacetamide (PubChem CID 103287494) has the molecular formula C6H14N2O4S and a molecular weight of 210.25 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-methylsulfonylacetamide.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-methylsulfonylacetamide
PubChem CID103287494
Molecular FormulaC6H14N2O4S
Molecular Weight210.25 g/mol
Exact Mass210.07
IUPAC Name2-(2-methoxyethylamino)-N-methylsulfonylacetamide
SMILESCOCCNCC(=O)NS(C)(=O)=O
InChIInChI=1S/C6H14N2O4S/c1-12-4-3-7-5-6(9)8-13(2,10)11/h7H,3-5H2,1-2H3,(H,8,9)
InChIKeyRTZKQANTMAMZFB-UHFFFAOYSA-N
XLogP-1.70
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 5-1.70
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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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-methylsulfonylacetamide?
The IUPAC name of 2-(2-methoxyethylamino)-N-methylsulfonylacetamide (CID 103287494) is 2-(2-methoxyethylamino)-N-methylsulfonylacetamide.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-methylsulfonylacetamide?
The canonical SMILES for 2-(2-methoxyethylamino)-N-methylsulfonylacetamide is COCCNCC(=O)NS(C)(=O)=O.
What is the InChIKey of 2-(2-methoxyethylamino)-N-methylsulfonylacetamide?
The InChIKey is RTZKQANTMAMZFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O4S/c1-12-4-3-7-5-6(9)8-13(2,10)11/h7H,3-5H2,1-2H3,(H,8,9).
What are the key properties of 2-(2-methoxyethylamino)-N-methylsulfonylacetamide?
2-(2-methoxyethylamino)-N-methylsulfonylacetamide has a molecular weight of 210.25 g/mol, XLogP of -1.70, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-methylsulfonylacetamide is sourced from PubChem (CID 103287494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).