3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione

C11H17N3O3 — CID 113218073

IUPAC3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione
SMILESCC(C(=O)N1CCCCC1)N1C(=O)CNC1=O
InChIInChI=1S/C11H17N3O3/c1-8(14-9(15)7-12-11(14)17)10(16)13-5-3-2-4-6-13/h8H,2-7H2,1H3,(H,12,17)
InChIKeyGIIPIUZCSUOHDZ-UHFFFAOYSA-N
MW239.27 g/mol
LogP-0.06
Rot. Bonds2

About 3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione

3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione (PubChem CID 113218073) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is 3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione
PubChem CID113218073
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC Name3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione
SMILESCC(C(=O)N1CCCCC1)N1C(=O)CNC1=O
InChIInChI=1S/C11H17N3O3/c1-8(14-9(15)7-12-11(14)17)10(16)13-5-3-2-4-6-13/h8H,2-7H2,1H3,(H,12,17)
InChIKeyGIIPIUZCSUOHDZ-UHFFFAOYSA-N
XLogP-0.06
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione?
The IUPAC name of 3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione (CID 113218073) is 3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione is CC(C(=O)N1CCCCC1)N1C(=O)CNC1=O.
What is the InChIKey of 3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione?
The InChIKey is GIIPIUZCSUOHDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-8(14-9(15)7-12-11(14)17)10(16)13-5-3-2-4-6-13/h8H,2-7H2,1H3,(H,12,17).
What are the key properties of 3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione?
3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione has a molecular weight of 239.27 g/mol, XLogP of -0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione is sourced from PubChem (CID 113218073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).