2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide

C8H13N3O4 — CID 60717947

IUPAC2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide
SMILESCONC(=O)CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C8H13N3O4/c1-8(2)6(13)11(7(14)9-8)4-5(12)10-15-3/h4H2,1-3H3,(H,9,14)(H,10,12)
InChIKeyKMBYGLSBWQJYOX-UHFFFAOYSA-N
MW215.21 g/mol
LogP-1.01
Rot. Bonds3

About 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide

2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide (PubChem CID 60717947) has the molecular formula C8H13N3O4 and a molecular weight of 215.21 g/mol. Its IUPAC name is 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide.

Molecular Properties

Compound Name2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide
PubChem CID60717947
Molecular FormulaC8H13N3O4
Molecular Weight215.21 g/mol
Exact Mass215.09
IUPAC Name2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide
SMILESCONC(=O)CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C8H13N3O4/c1-8(2)6(13)11(7(14)9-8)4-5(12)10-15-3/h4H2,1-3H3,(H,9,14)(H,10,12)
InChIKeyKMBYGLSBWQJYOX-UHFFFAOYSA-N
XLogP-1.01
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 5-1.01
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-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide?
The IUPAC name of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide (CID 60717947) is 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide.
What is the SMILES notation for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide?
The canonical SMILES for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide is CONC(=O)CN1C(=O)NC(C)(C)C1=O.
What is the InChIKey of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide?
The InChIKey is KMBYGLSBWQJYOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O4/c1-8(2)6(13)11(7(14)9-8)4-5(12)10-15-3/h4H2,1-3H3,(H,9,14)(H,10,12).
What are the key properties of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide?
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide has a molecular weight of 215.21 g/mol, XLogP of -1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methoxyacetamide is sourced from PubChem (CID 60717947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).