5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione

C9H13N3O4 — CID 4737195

IUPAC5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(CC(=O)N2CCOCC2)N1
InChIInChI=1S/C9H13N3O4/c13-7(12-1-3-16-4-2-12)5-6-8(14)11-9(15)10-6/h6H,1-5H2,(H2,10,11,14,15)
InChIKeyMOEWNZSTUMZZHS-UHFFFAOYSA-N
MW227.22 g/mol
LogP-1.56
Rot. Bonds2

About 5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione

5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione (PubChem CID 4737195) has the molecular formula C9H13N3O4 and a molecular weight of 227.22 g/mol. Its IUPAC name is 5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione
PubChem CID4737195
Molecular FormulaC9H13N3O4
Molecular Weight227.22 g/mol
Exact Mass227.09
IUPAC Name5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(CC(=O)N2CCOCC2)N1
InChIInChI=1S/C9H13N3O4/c13-7(12-1-3-16-4-2-12)5-6-8(14)11-9(15)10-6/h6H,1-5H2,(H2,10,11,14,15)
InChIKeyMOEWNZSTUMZZHS-UHFFFAOYSA-N
XLogP-1.56
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.22
LogP ≤ 5-1.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione?
The IUPAC name of 5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione (CID 4737195) is 5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione is O=C1NC(=O)C(CC(=O)N2CCOCC2)N1.
What is the InChIKey of 5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione?
The InChIKey is MOEWNZSTUMZZHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O4/c13-7(12-1-3-16-4-2-12)5-6-8(14)11-9(15)10-6/h6H,1-5H2,(H2,10,11,14,15).
What are the key properties of 5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione?
5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione has a molecular weight of 227.22 g/mol, XLogP of -1.56, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 4737195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).