4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione

C10H12N2O6 — CID 513917

IUPAC4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione
SMILESO=C1CN(CCN2CC(=O)OC(=O)C2)CC(=O)O1
InChIInChI=1S/C10H12N2O6/c13-7-3-11(4-8(14)17-7)1-2-12-5-9(15)18-10(16)6-12/h1-6H2
InChIKeyPOLIXZIAIMAECK-UHFFFAOYSA-N
MW256.21 g/mol
LogP-2.24
Rot. Bonds3

About 4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione

4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione (PubChem CID 513917) has the molecular formula C10H12N2O6 and a molecular weight of 256.21 g/mol. Its IUPAC name is 4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione.

Molecular Properties

Compound Name4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione
PubChem CID513917
Molecular FormulaC10H12N2O6
Molecular Weight256.21 g/mol
Exact Mass256.07
IUPAC Name4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione
SMILESO=C1CN(CCN2CC(=O)OC(=O)C2)CC(=O)O1
InChIInChI=1S/C10H12N2O6/c13-7-3-11(4-8(14)17-7)1-2-12-5-9(15)18-10(16)6-12/h1-6H2
InChIKeyPOLIXZIAIMAECK-UHFFFAOYSA-N
XLogP-2.24
TPSA93.22 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.21
LogP ≤ 5-2.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione?
The IUPAC name of 4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione (CID 513917) is 4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione.
What is the SMILES notation for 4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione?
The canonical SMILES for 4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione is O=C1CN(CCN2CC(=O)OC(=O)C2)CC(=O)O1.
What is the InChIKey of 4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione?
The InChIKey is POLIXZIAIMAECK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O6/c13-7-3-11(4-8(14)17-7)1-2-12-5-9(15)18-10(16)6-12/h1-6H2.
What are the key properties of 4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione?
4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione has a molecular weight of 256.21 g/mol, XLogP of -2.24, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione is sourced from PubChem (CID 513917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).