2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide

C9H17N3O3 — CID 112673820

IUPAC2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide
SMILESCC(NOCC(N)=O)C(=O)N1CCCC1
InChIInChI=1S/C9H17N3O3/c1-7(11-15-6-8(10)13)9(14)12-4-2-3-5-12/h7,11H,2-6H2,1H3,(H2,10,13)
InChIKeyXVJJTOFDGOXYRP-UHFFFAOYSA-N
MW215.25 g/mol
LogP-1.00
Rot. Bonds5

About 2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide

2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide (PubChem CID 112673820) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is 2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide.

Molecular Properties

Compound Name2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide
PubChem CID112673820
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC Name2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide
SMILESCC(NOCC(N)=O)C(=O)N1CCCC1
InChIInChI=1S/C9H17N3O3/c1-7(11-15-6-8(10)13)9(14)12-4-2-3-5-12/h7,11H,2-6H2,1H3,(H2,10,13)
InChIKeyXVJJTOFDGOXYRP-UHFFFAOYSA-N
XLogP-1.00
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-1.00
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-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide?
The IUPAC name of 2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide (CID 112673820) is 2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide.
What is the SMILES notation for 2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide?
The canonical SMILES for 2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide is CC(NOCC(N)=O)C(=O)N1CCCC1.
What is the InChIKey of 2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide?
The InChIKey is XVJJTOFDGOXYRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-7(11-15-6-8(10)13)9(14)12-4-2-3-5-12/h7,11H,2-6H2,1H3,(H2,10,13).
What are the key properties of 2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide?
2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide has a molecular weight of 215.25 g/mol, XLogP of -1.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]oxyacetamide is sourced from PubChem (CID 112673820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).