2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide

C8H14N2O3 — CID 71789093

IUPAC2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide
SMILESCCOCC(=O)NC1CNC(=O)C1
InChIInChI=1S/C8H14N2O3/c1-2-13-5-8(12)10-6-3-7(11)9-4-6/h6H,2-5H2,1H3,(H,9,11)(H,10,12)
InChIKeyMNEBORNDTOTAIT-UHFFFAOYSA-N
MW186.21 g/mol
LogP-0.97
Rot. Bonds4

About 2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide

2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide (PubChem CID 71789093) has the molecular formula C8H14N2O3 and a molecular weight of 186.21 g/mol. Its IUPAC name is 2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide.

Molecular Properties

Compound Name2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide
PubChem CID71789093
Molecular FormulaC8H14N2O3
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC Name2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide
SMILESCCOCC(=O)NC1CNC(=O)C1
InChIInChI=1S/C8H14N2O3/c1-2-13-5-8(12)10-6-3-7(11)9-4-6/h6H,2-5H2,1H3,(H,9,11)(H,10,12)
InChIKeyMNEBORNDTOTAIT-UHFFFAOYSA-N
XLogP-0.97
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-0.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide?
The IUPAC name of 2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide (CID 71789093) is 2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide.
What is the SMILES notation for 2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide?
The canonical SMILES for 2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide is CCOCC(=O)NC1CNC(=O)C1.
What is the InChIKey of 2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide?
The InChIKey is MNEBORNDTOTAIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3/c1-2-13-5-8(12)10-6-3-7(11)9-4-6/h6H,2-5H2,1H3,(H,9,11)(H,10,12).
What are the key properties of 2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide?
2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide has a molecular weight of 186.21 g/mol, XLogP of -0.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(5-oxopyrrolidin-3-yl)acetamide is sourced from PubChem (CID 71789093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).