1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione

C13H24N2O5 — CID 104566190

IUPAC1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione
SMILESCOCCOCCOCCN1C(=O)CNC(C)(C)C1=O
InChIInChI=1S/C13H24N2O5/c1-13(2)12(17)15(11(16)10-14-13)4-5-19-8-9-20-7-6-18-3/h14H,4-10H2,1-3H3
InChIKeySVORHPFNQNAOMI-UHFFFAOYSA-N
MW288.34 g/mol
LogP-0.60
Rot. Bonds9

About 1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione

1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione (PubChem CID 104566190) has the molecular formula C13H24N2O5 and a molecular weight of 288.34 g/mol. Its IUPAC name is 1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione.

Molecular Properties

Compound Name1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione
PubChem CID104566190
Molecular FormulaC13H24N2O5
Molecular Weight288.34 g/mol
Exact Mass288.17
IUPAC Name1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione
SMILESCOCCOCCOCCN1C(=O)CNC(C)(C)C1=O
InChIInChI=1S/C13H24N2O5/c1-13(2)12(17)15(11(16)10-14-13)4-5-19-8-9-20-7-6-18-3/h14H,4-10H2,1-3H3
InChIKeySVORHPFNQNAOMI-UHFFFAOYSA-N
XLogP-0.60
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.34
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione 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 1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione?
The IUPAC name of 1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione (CID 104566190) is 1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione.
What is the SMILES notation for 1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione?
The canonical SMILES for 1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione is COCCOCCOCCN1C(=O)CNC(C)(C)C1=O.
What is the InChIKey of 1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione?
The InChIKey is SVORHPFNQNAOMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O5/c1-13(2)12(17)15(11(16)10-14-13)4-5-19-8-9-20-7-6-18-3/h14H,4-10H2,1-3H3.
What are the key properties of 1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione?
1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione has a molecular weight of 288.34 g/mol, XLogP of -0.60, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione is sourced from PubChem (CID 104566190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).