2-(butylsulfonylamino)oxyacetamide

C6H14N2O4S — CID 112673472

IUPAC2-(butylsulfonylamino)oxyacetamide
SMILESCCCCS(=O)(=O)NOCC(N)=O
InChIInChI=1S/C6H14N2O4S/c1-2-3-4-13(10,11)8-12-5-6(7)9/h8H,2-5H2,1H3,(H2,7,9)
InChIKeyQGDQQASMFYUWCQ-UHFFFAOYSA-N
MW210.25 g/mol
LogP-0.88
Rot. Bonds7

About 2-(butylsulfonylamino)oxyacetamide

2-(butylsulfonylamino)oxyacetamide (PubChem CID 112673472) has the molecular formula C6H14N2O4S and a molecular weight of 210.25 g/mol. Its IUPAC name is 2-(butylsulfonylamino)oxyacetamide.

Molecular Properties

Compound Name2-(butylsulfonylamino)oxyacetamide
PubChem CID112673472
Molecular FormulaC6H14N2O4S
Molecular Weight210.25 g/mol
Exact Mass210.07
IUPAC Name2-(butylsulfonylamino)oxyacetamide
SMILESCCCCS(=O)(=O)NOCC(N)=O
InChIInChI=1S/C6H14N2O4S/c1-2-3-4-13(10,11)8-12-5-6(7)9/h8H,2-5H2,1H3,(H2,7,9)
InChIKeyQGDQQASMFYUWCQ-UHFFFAOYSA-N
XLogP-0.88
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 5-0.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(butylsulfonylamino)oxyacetamide?
The IUPAC name of 2-(butylsulfonylamino)oxyacetamide (CID 112673472) is 2-(butylsulfonylamino)oxyacetamide.
What is the SMILES notation for 2-(butylsulfonylamino)oxyacetamide?
The canonical SMILES for 2-(butylsulfonylamino)oxyacetamide is CCCCS(=O)(=O)NOCC(N)=O.
What is the InChIKey of 2-(butylsulfonylamino)oxyacetamide?
The InChIKey is QGDQQASMFYUWCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O4S/c1-2-3-4-13(10,11)8-12-5-6(7)9/h8H,2-5H2,1H3,(H2,7,9).
What are the key properties of 2-(butylsulfonylamino)oxyacetamide?
2-(butylsulfonylamino)oxyacetamide has a molecular weight of 210.25 g/mol, XLogP of -0.88, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butylsulfonylamino)oxyacetamide is sourced from PubChem (CID 112673472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).