2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide

C13H20N2O4 — CID 9378946

IUPAC2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN1C(=O)CC2(CCCC2)C1=O
InChIInChI=1S/C13H20N2O4/c1-19-7-6-14-10(16)9-15-11(17)8-13(12(15)18)4-2-3-5-13/h2-9H2,1H3,(H,14,16)
InChIKeyXXCMJYJHVLGFEJ-UHFFFAOYSA-N
MW268.31 g/mol
LogP0.07
Rot. Bonds5

About 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide

2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide (PubChem CID 9378946) has the molecular formula C13H20N2O4 and a molecular weight of 268.31 g/mol. Its IUPAC name is 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide
PubChem CID9378946
Molecular FormulaC13H20N2O4
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC Name2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN1C(=O)CC2(CCCC2)C1=O
InChIInChI=1S/C13H20N2O4/c1-19-7-6-14-10(16)9-15-11(17)8-13(12(15)18)4-2-3-5-13/h2-9H2,1H3,(H,14,16)
InChIKeyXXCMJYJHVLGFEJ-UHFFFAOYSA-N
XLogP0.07
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide (CID 9378946) is 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide is COCCNC(=O)CN1C(=O)CC2(CCCC2)C1=O.
What is the InChIKey of 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide?
The InChIKey is XXCMJYJHVLGFEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O4/c1-19-7-6-14-10(16)9-15-11(17)8-13(12(15)18)4-2-3-5-13/h2-9H2,1H3,(H,14,16).
What are the key properties of 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide?
2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide has a molecular weight of 268.31 g/mol, XLogP of 0.07, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dioxo-2-azaspiro[4.4]nonan-2-yl)-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 9378946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).