2-(methylamino)-N-methylsulfonylacetamide

C4H10N2O3S — CID 90327624

IUPAC2-(methylamino)-N-methylsulfonylacetamide
SMILESCNCC(=O)NS(C)(=O)=O
InChIInChI=1S/C4H10N2O3S/c1-5-3-4(7)6-10(2,8)9/h5H,3H2,1-2H3,(H,6,7)
InChIKeyORHVBKCBXUCYIL-UHFFFAOYSA-N
MW166.20 g/mol
LogP-1.72
Rot. Bonds3

About 2-(methylamino)-N-methylsulfonylacetamide

2-(methylamino)-N-methylsulfonylacetamide (PubChem CID 90327624) has the molecular formula C4H10N2O3S and a molecular weight of 166.20 g/mol. Its IUPAC name is 2-(methylamino)-N-methylsulfonylacetamide.

Molecular Properties

Compound Name2-(methylamino)-N-methylsulfonylacetamide
PubChem CID90327624
Molecular FormulaC4H10N2O3S
Molecular Weight166.20 g/mol
Exact Mass166.04
IUPAC Name2-(methylamino)-N-methylsulfonylacetamide
SMILESCNCC(=O)NS(C)(=O)=O
InChIInChI=1S/C4H10N2O3S/c1-5-3-4(7)6-10(2,8)9/h5H,3H2,1-2H3,(H,6,7)
InChIKeyORHVBKCBXUCYIL-UHFFFAOYSA-N
XLogP-1.72
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 5-1.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-methylsulfonylacetamide?
The IUPAC name of 2-(methylamino)-N-methylsulfonylacetamide (CID 90327624) is 2-(methylamino)-N-methylsulfonylacetamide.
What is the SMILES notation for 2-(methylamino)-N-methylsulfonylacetamide?
The canonical SMILES for 2-(methylamino)-N-methylsulfonylacetamide is CNCC(=O)NS(C)(=O)=O.
What is the InChIKey of 2-(methylamino)-N-methylsulfonylacetamide?
The InChIKey is ORHVBKCBXUCYIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O3S/c1-5-3-4(7)6-10(2,8)9/h5H,3H2,1-2H3,(H,6,7).
What are the key properties of 2-(methylamino)-N-methylsulfonylacetamide?
2-(methylamino)-N-methylsulfonylacetamide has a molecular weight of 166.20 g/mol, XLogP of -1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-methylsulfonylacetamide is sourced from PubChem (CID 90327624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).