N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide

C8H14N2O3 — CID 60700584

IUPACN-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCCONC(=O)CN1CCCC1=O
InChIInChI=1S/C8H14N2O3/c1-2-13-9-7(11)6-10-5-3-4-8(10)12/h2-6H2,1H3,(H,9,11)
InChIKeyXCGJWKNXGHRFRL-UHFFFAOYSA-N
MW186.21 g/mol
LogP-0.32
Rot. Bonds4

About N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide

N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide (PubChem CID 60700584) has the molecular formula C8H14N2O3 and a molecular weight of 186.21 g/mol. Its IUPAC name is N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide
PubChem CID60700584
Molecular FormulaC8H14N2O3
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC NameN-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCCONC(=O)CN1CCCC1=O
InChIInChI=1S/C8H14N2O3/c1-2-13-9-7(11)6-10-5-3-4-8(10)12/h2-6H2,1H3,(H,9,11)
InChIKeyXCGJWKNXGHRFRL-UHFFFAOYSA-N
XLogP-0.32
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide (CID 60700584) is N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide is CCONC(=O)CN1CCCC1=O.
What is the InChIKey of N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide?
The InChIKey is XCGJWKNXGHRFRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3/c1-2-13-9-7(11)6-10-5-3-4-8(10)12/h2-6H2,1H3,(H,9,11).
What are the key properties of N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide?
N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide has a molecular weight of 186.21 g/mol, XLogP of -0.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-2-(2-oxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 60700584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).