2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide

C11H19N3O4 — CID 107202709

IUPAC2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide
SMILESCN(CCCCCO)C(=O)CN1C(=O)CNC1=O
InChIInChI=1S/C11H19N3O4/c1-13(5-3-2-4-6-15)10(17)8-14-9(16)7-12-11(14)18/h15H,2-8H2,1H3,(H,12,18)
InChIKeyQHSCJLWBHSKEGF-UHFFFAOYSA-N
MW257.29 g/mol
LogP-0.84
Rot. Bonds7

About 2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide

2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide (PubChem CID 107202709) has the molecular formula C11H19N3O4 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide
PubChem CID107202709
Molecular FormulaC11H19N3O4
Molecular Weight257.29 g/mol
Exact Mass257.14
IUPAC Name2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide
SMILESCN(CCCCCO)C(=O)CN1C(=O)CNC1=O
InChIInChI=1S/C11H19N3O4/c1-13(5-3-2-4-6-15)10(17)8-14-9(16)7-12-11(14)18/h15H,2-8H2,1H3,(H,12,18)
InChIKeyQHSCJLWBHSKEGF-UHFFFAOYSA-N
XLogP-0.84
TPSA89.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 5-0.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide?
The IUPAC name of 2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide (CID 107202709) is 2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide.
What is the SMILES notation for 2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide?
The canonical SMILES for 2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide is CN(CCCCCO)C(=O)CN1C(=O)CNC1=O.
What is the InChIKey of 2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide?
The InChIKey is QHSCJLWBHSKEGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O4/c1-13(5-3-2-4-6-15)10(17)8-14-9(16)7-12-11(14)18/h15H,2-8H2,1H3,(H,12,18).
What are the key properties of 2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide?
2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide has a molecular weight of 257.29 g/mol, XLogP of -0.84, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxoimidazolidin-1-yl)-N-(5-hydroxypentyl)-N-methylacetamide is sourced from PubChem (CID 107202709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).