2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide

C10H13N3O4 — CID 2438857

IUPAC2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
SMILESNC(=O)CN1C(=O)C(=O)N(C2CCCC2)C1=O
InChIInChI=1S/C10H13N3O4/c11-7(14)5-12-8(15)9(16)13(10(12)17)6-3-1-2-4-6/h6H,1-5H2,(H2,11,14)
InChIKeyXTZRLFPRSKQKKG-UHFFFAOYSA-N
MW239.23 g/mol
LogP-0.79
Rot. Bonds3

About 2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide

2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide (PubChem CID 2438857) has the molecular formula C10H13N3O4 and a molecular weight of 239.23 g/mol. Its IUPAC name is 2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide.

Molecular Properties

Compound Name2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
PubChem CID2438857
Molecular FormulaC10H13N3O4
Molecular Weight239.23 g/mol
Exact Mass239.09
IUPAC Name2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
SMILESNC(=O)CN1C(=O)C(=O)N(C2CCCC2)C1=O
InChIInChI=1S/C10H13N3O4/c11-7(14)5-12-8(15)9(16)13(10(12)17)6-3-1-2-4-6/h6H,1-5H2,(H2,11,14)
InChIKeyXTZRLFPRSKQKKG-UHFFFAOYSA-N
XLogP-0.79
TPSA100.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.23
LogP ≤ 5-0.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
The IUPAC name of 2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide (CID 2438857) is 2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide.
What is the SMILES notation for 2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
The canonical SMILES for 2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide is NC(=O)CN1C(=O)C(=O)N(C2CCCC2)C1=O.
What is the InChIKey of 2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
The InChIKey is XTZRLFPRSKQKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O4/c11-7(14)5-12-8(15)9(16)13(10(12)17)6-3-1-2-4-6/h6H,1-5H2,(H2,11,14).
What are the key properties of 2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide has a molecular weight of 239.23 g/mol, XLogP of -0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide is sourced from PubChem (CID 2438857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).