N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide

C8H13N3O4 — CID 112550502

IUPACN-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESNC(=O)CONC(=O)CN1CCCC1=O
InChIInChI=1S/C8H13N3O4/c9-6(12)5-15-10-7(13)4-11-3-1-2-8(11)14/h1-5H2,(H2,9,12)(H,10,13)
InChIKeyQYEUHCKLMYLQGB-UHFFFAOYSA-N
MW215.21 g/mol
LogP-1.86
Rot. Bonds5

About N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide

N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide (PubChem CID 112550502) has the molecular formula C8H13N3O4 and a molecular weight of 215.21 g/mol. Its IUPAC name is N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide
PubChem CID112550502
Molecular FormulaC8H13N3O4
Molecular Weight215.21 g/mol
Exact Mass215.09
IUPAC NameN-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESNC(=O)CONC(=O)CN1CCCC1=O
InChIInChI=1S/C8H13N3O4/c9-6(12)5-15-10-7(13)4-11-3-1-2-8(11)14/h1-5H2,(H2,9,12)(H,10,13)
InChIKeyQYEUHCKLMYLQGB-UHFFFAOYSA-N
XLogP-1.86
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 5-1.86
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 N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide (CID 112550502) is N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide is NC(=O)CONC(=O)CN1CCCC1=O.
What is the InChIKey of N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide?
The InChIKey is QYEUHCKLMYLQGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O4/c9-6(12)5-15-10-7(13)4-11-3-1-2-8(11)14/h1-5H2,(H2,9,12)(H,10,13).
What are the key properties of N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide?
N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide has a molecular weight of 215.21 g/mol, XLogP of -1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethoxy)-2-(2-oxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 112550502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).