2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide

C14H23N3O4 — CID 2088946

IUPAC2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN1C(=O)NC2(CCCCCC2)C1=O
InChIInChI=1S/C14H23N3O4/c1-21-9-8-15-11(18)10-17-12(19)14(16-13(17)20)6-4-2-3-5-7-14/h2-10H2,1H3,(H,15,18)(H,16,20)
InChIKeyWAFZSIRRUJOLEY-UHFFFAOYSA-N
MW297.36 g/mol
LogP0.39
Rot. Bonds5

About 2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide

2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide (PubChem CID 2088946) has the molecular formula C14H23N3O4 and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide
PubChem CID2088946
Molecular FormulaC14H23N3O4
Molecular Weight297.36 g/mol
Exact Mass297.17
IUPAC Name2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN1C(=O)NC2(CCCCCC2)C1=O
InChIInChI=1S/C14H23N3O4/c1-21-9-8-15-11(18)10-17-12(19)14(16-13(17)20)6-4-2-3-5-7-14/h2-10H2,1H3,(H,15,18)(H,16,20)
InChIKeyWAFZSIRRUJOLEY-UHFFFAOYSA-N
XLogP0.39
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-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-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide (CID 2088946) is 2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide is COCCNC(=O)CN1C(=O)NC2(CCCCCC2)C1=O.
What is the InChIKey of 2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide?
The InChIKey is WAFZSIRRUJOLEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O4/c1-21-9-8-15-11(18)10-17-12(19)14(16-13(17)20)6-4-2-3-5-7-14/h2-10H2,1H3,(H,15,18)(H,16,20).
What are the key properties of 2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide?
2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide has a molecular weight of 297.36 g/mol, XLogP of 0.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 2088946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).