1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione

C10H15N3O4 — CID 43348289

IUPAC1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione
SMILESO=C1NC(=O)N(CCCN2CCOCC2)C1=O
InChIInChI=1S/C10H15N3O4/c14-8-9(15)13(10(16)11-8)3-1-2-12-4-6-17-7-5-12/h1-7H2,(H,11,14,16)
InChIKeyJWDKFGULYNGENK-UHFFFAOYSA-N
MW241.25 g/mol
LogP-1.21
Rot. Bonds4

About 1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione

1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione (PubChem CID 43348289) has the molecular formula C10H15N3O4 and a molecular weight of 241.25 g/mol. Its IUPAC name is 1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione.

Molecular Properties

Compound Name1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione
PubChem CID43348289
Molecular FormulaC10H15N3O4
Molecular Weight241.25 g/mol
Exact Mass241.11
IUPAC Name1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione
SMILESO=C1NC(=O)N(CCCN2CCOCC2)C1=O
InChIInChI=1S/C10H15N3O4/c14-8-9(15)13(10(16)11-8)3-1-2-12-4-6-17-7-5-12/h1-7H2,(H,11,14,16)
InChIKeyJWDKFGULYNGENK-UHFFFAOYSA-N
XLogP-1.21
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 5-1.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione?
The IUPAC name of 1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione (CID 43348289) is 1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione.
What is the SMILES notation for 1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione?
The canonical SMILES for 1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione is O=C1NC(=O)N(CCCN2CCOCC2)C1=O.
What is the InChIKey of 1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione?
The InChIKey is JWDKFGULYNGENK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O4/c14-8-9(15)13(10(16)11-8)3-1-2-12-4-6-17-7-5-12/h1-7H2,(H,11,14,16).
What are the key properties of 1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione?
1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione has a molecular weight of 241.25 g/mol, XLogP of -1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-morpholin-4-ylpropyl)imidazolidine-2,4,5-trione is sourced from PubChem (CID 43348289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).