3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione

C10H17N3O3 — CID 43637711

IUPAC3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione
SMILESO=C1CC(NCCN2CCOCC2)C(=O)N1
InChIInChI=1S/C10H17N3O3/c14-9-7-8(10(15)12-9)11-1-2-13-3-5-16-6-4-13/h8,11H,1-7H2,(H,12,14,15)
InChIKeyXKNSZOYUFIEABW-UHFFFAOYSA-N
MW227.26 g/mol
LogP-1.68
Rot. Bonds4

About 3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione

3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione (PubChem CID 43637711) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is 3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione
PubChem CID43637711
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC Name3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione
SMILESO=C1CC(NCCN2CCOCC2)C(=O)N1
InChIInChI=1S/C10H17N3O3/c14-9-7-8(10(15)12-9)11-1-2-13-3-5-16-6-4-13/h8,11H,1-7H2,(H,12,14,15)
InChIKeyXKNSZOYUFIEABW-UHFFFAOYSA-N
XLogP-1.68
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-1.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione?
The IUPAC name of 3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione (CID 43637711) is 3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione?
The canonical SMILES for 3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione is O=C1CC(NCCN2CCOCC2)C(=O)N1.
What is the InChIKey of 3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione?
The InChIKey is XKNSZOYUFIEABW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c14-9-7-8(10(15)12-9)11-1-2-13-3-5-16-6-4-13/h8,11H,1-7H2,(H,12,14,15).
What are the key properties of 3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione?
3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione has a molecular weight of 227.26 g/mol, XLogP of -1.68, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-morpholin-4-ylethylamino)pyrrolidine-2,5-dione is sourced from PubChem (CID 43637711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).