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

C9H10N2O6 — CID 21035581

IUPAC4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione
SMILESO=C1CN(CN2CC(=O)OC(=O)C2)CC(=O)O1
InChIInChI=1S/C9H10N2O6/c12-6-1-10(2-7(13)16-6)5-11-3-8(14)17-9(15)4-11/h1-5H2
InChIKeyFBGTUPHDWXGNDG-UHFFFAOYSA-N
MW242.19 g/mol
LogP-2.29
Rot. Bonds2

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

4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione (PubChem CID 21035581) has the molecular formula C9H10N2O6 and a molecular weight of 242.19 g/mol. Its IUPAC name is 4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione.

Molecular Properties

Compound Name4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione
PubChem CID21035581
Molecular FormulaC9H10N2O6
Molecular Weight242.19 g/mol
Exact Mass242.05
IUPAC Name4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione
SMILESO=C1CN(CN2CC(=O)OC(=O)C2)CC(=O)O1
InChIInChI=1S/C9H10N2O6/c12-6-1-10(2-7(13)16-6)5-11-3-8(14)17-9(15)4-11/h1-5H2
InChIKeyFBGTUPHDWXGNDG-UHFFFAOYSA-N
XLogP-2.29
TPSA93.22 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.19
LogP ≤ 5-2.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze 4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-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

Related Compounds

Ethylenediaminetetraacetic dianhydride
CID 513917
2-Morpholin-4-ylethyl 2-morpholin-4-ylacetate
CID 12496761
2,2-Dimorpholin-4-ylacetic acid
CID 12864794
Methyl 2,2-dimorpholinoacetate
CID 14087944
2,6-Morpholinedione, 4,4'-(1,3-propanediyl)bis-
CID 14818436
2-[2,2-Bis(2,6-dioxomorpholin-4-yl)ethyl-ethylamino]acetic acid
CID 19105709
2-(2,6-Dioxomorpholin-4-yl)ethyl 2-(2,6-dioxomorpholin-4-yl)acetate
CID 20676350
4-[2-[2-(2,6-Dioxomorpholin-4-yl)ethoxy]ethyl]morpholine-2,6-dione
CID 21520814
2,2-Dimorpholin-4-ylacetate
CID 22557659
3-(2-Oxomorpholin-4-yl)morpholin-2-one
CID 53913237
4-[1-(2,6-Dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione
CID 88235340
3,9-Dioxa-6-azoniaspiro[5.5]undecane-2,4,8,10-tetrone
CID 91515932

Frequently Asked Questions

What is the IUPAC name of 4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione?
The IUPAC name of 4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione (CID 21035581) is 4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione.
What is the SMILES notation for 4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione?
The canonical SMILES for 4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione is O=C1CN(CN2CC(=O)OC(=O)C2)CC(=O)O1.
What is the InChIKey of 4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione?
The InChIKey is FBGTUPHDWXGNDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O6/c12-6-1-10(2-7(13)16-6)5-11-3-8(14)17-9(15)4-11/h1-5H2.
What are the key properties of 4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione?
4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione has a molecular weight of 242.19 g/mol, XLogP of -2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,6-dioxomorpholin-4-yl)methyl]morpholine-2,6-dione is sourced from PubChem (CID 21035581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).