ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate

C10H14N2O5 — CID 141279894

IUPACethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate
SMILESCCOC(=O)C(=O)NC(=O)C(=O)N1CCCC1
InChIInChI=1S/C10H14N2O5/c1-2-17-10(16)8(14)11-7(13)9(15)12-5-3-4-6-12/h2-6H2,1H3,(H,11,13,14)
InChIKeyHVAXQIRDCLONHG-UHFFFAOYSA-N
MW242.23 g/mol
LogP-1.19
Rot. Bonds1

About ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate

ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate (PubChem CID 141279894) has the molecular formula C10H14N2O5 and a molecular weight of 242.23 g/mol. Its IUPAC name is ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate
PubChem CID141279894
Molecular FormulaC10H14N2O5
Molecular Weight242.23 g/mol
Exact Mass242.09
IUPAC Nameethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate
SMILESCCOC(=O)C(=O)NC(=O)C(=O)N1CCCC1
InChIInChI=1S/C10H14N2O5/c1-2-17-10(16)8(14)11-7(13)9(15)12-5-3-4-6-12/h2-6H2,1H3,(H,11,13,14)
InChIKeyHVAXQIRDCLONHG-UHFFFAOYSA-N
XLogP-1.19
TPSA92.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.23
LogP ≤ 5-1.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-oxo-N-prop-1-en-2-yl-2-pyrrolidin-1-ylacetamide
CID 89129366
ethyl N-[4-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]phenyl]carbamate
CID 110179174
ethyl azacycloundecane-1-carboxylate
CID 67670496
ethyl pyrrolidine-1-carboxylate;methanol
CID 153400940
2-(azepan-1-yl)-N-ethyl-2-oxoacetamide
CID 108521159
ethyl 2-hydroxyimino-2-piperidin-1-ylacetate
CID 53396291
ethyl 4-[2-(methylamino)-2-oxoacetyl]piperazine-1-carboxylate
CID 108526200
ethyl 3-methyl-2-piperidin-1-ylbut-2-enoate
CID 14613354
ethyl azetidine-1-carboxylate
CID 14088501
ethyl 2-oxo-2-(propan-2-ylamino)acetate
CID 5001766
ethyl 2-oxo-3-(pyrrolidine-1-carbonylamino)pentanoate
CID 58602905
diethyl (Z)-2-[(E)-2-pyrrolidin-1-ylprop-1-enyl]but-2-enedioate
CID 164676347

Frequently Asked Questions

What is the IUPAC name of ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate?
The IUPAC name of ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate (CID 141279894) is ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate.
What is the SMILES notation for ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate?
The canonical SMILES for ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate is CCOC(=O)C(=O)NC(=O)C(=O)N1CCCC1.
What is the InChIKey of ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate?
The InChIKey is HVAXQIRDCLONHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O5/c1-2-17-10(16)8(14)11-7(13)9(15)12-5-3-4-6-12/h2-6H2,1H3,(H,11,13,14).
What are the key properties of ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate?
ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate has a molecular weight of 242.23 g/mol, XLogP of -1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylacetyl)amino]acetate is sourced from PubChem (CID 141279894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).