2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide

C11H19N3O4 — CID 46540735

IUPAC2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide
SMILESCCONC(=O)CN1C(=O)NC(CC)(CC)C1=O
InChIInChI=1S/C11H19N3O4/c1-4-11(5-2)9(16)14(10(17)12-11)7-8(15)13-18-6-3/h4-7H2,1-3H3,(H,12,17)(H,13,15)
InChIKeyRZKMQDJNNVONOA-UHFFFAOYSA-N
MW257.29 g/mol
LogP0.16
Rot. Bonds6

About 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide

2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide (PubChem CID 46540735) has the molecular formula C11H19N3O4 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide.

Molecular Properties

Compound Name2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide
PubChem CID46540735
Molecular FormulaC11H19N3O4
Molecular Weight257.29 g/mol
Exact Mass257.14
IUPAC Name2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide
SMILESCCONC(=O)CN1C(=O)NC(CC)(CC)C1=O
InChIInChI=1S/C11H19N3O4/c1-4-11(5-2)9(16)14(10(17)12-11)7-8(15)13-18-6-3/h4-7H2,1-3H3,(H,12,17)(H,13,15)
InChIKeyRZKMQDJNNVONOA-UHFFFAOYSA-N
XLogP0.16
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide?
The IUPAC name of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide (CID 46540735) is 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide.
What is the SMILES notation for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide?
The canonical SMILES for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide is CCONC(=O)CN1C(=O)NC(CC)(CC)C1=O.
What is the InChIKey of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide?
The InChIKey is RZKMQDJNNVONOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O4/c1-4-11(5-2)9(16)14(10(17)12-11)7-8(15)13-18-6-3/h4-7H2,1-3H3,(H,12,17)(H,13,15).
What are the key properties of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide?
2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide has a molecular weight of 257.29 g/mol, XLogP of 0.16, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-ethoxyacetamide is sourced from PubChem (CID 46540735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).