3-piperidin-1-ylimidazolidine-2,4-dione

C8H13N3O2 — CID 107842327

IUPAC3-piperidin-1-ylimidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1N1CCCCC1
InChIInChI=1S/C8H13N3O2/c12-7-6-9-8(13)11(7)10-4-2-1-3-5-10/h1-6H2,(H,9,13)
InChIKeyKBVWHJLKPPECBY-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.06
Rot. Bonds1

About 3-piperidin-1-ylimidazolidine-2,4-dione

3-piperidin-1-ylimidazolidine-2,4-dione (PubChem CID 107842327) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 3-piperidin-1-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-piperidin-1-ylimidazolidine-2,4-dione
PubChem CID107842327
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name3-piperidin-1-ylimidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1N1CCCCC1
InChIInChI=1S/C8H13N3O2/c12-7-6-9-8(13)11(7)10-4-2-1-3-5-10/h1-6H2,(H,9,13)
InChIKeyKBVWHJLKPPECBY-UHFFFAOYSA-N
XLogP-0.06
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
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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Related Compounds

3-(4-methylpiperazin-1-yl)imidazolidine-2,4-dione
CID 107842329
3-(1-oxo-1-piperidin-1-ylpropan-2-yl)imidazolidine-2,4-dione
CID 113218073
4-methylidene-3-pyrrolidin-1-yl-1,3-oxazolidin-2-one
CID 69310532
3-(2-oxo-2-piperidin-1-ylethyl)imidazolidine-2,4-dione
CID 60624274
3-(chloromethyl)imidazolidine-2,4-dione
CID 55286294
1-piperidin-1-yl-3,4-dihydroquinolin-2-one
CID 19094699
1,7-diazabicyclo[5.2.1]decan-10-one
CID 90224464
5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one
CID 172698253
(1S,2S,6S,7S)-4-piperidin-1-yl-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 23306395
3-methylimidazolidine-2,4-dione;molecular hydrogen
CID 165132558
1-methyl-4-piperidin-1-ylpiperazin-2-one
CID 91056242
1,6-diazabicyclo[4.4.1]undecan-11-one
CID 70385964

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-ylimidazolidine-2,4-dione?
The IUPAC name of 3-piperidin-1-ylimidazolidine-2,4-dione (CID 107842327) is 3-piperidin-1-ylimidazolidine-2,4-dione.
What is the SMILES notation for 3-piperidin-1-ylimidazolidine-2,4-dione?
The canonical SMILES for 3-piperidin-1-ylimidazolidine-2,4-dione is O=C1CNC(=O)N1N1CCCCC1.
What is the InChIKey of 3-piperidin-1-ylimidazolidine-2,4-dione?
The InChIKey is KBVWHJLKPPECBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c12-7-6-9-8(13)11(7)10-4-2-1-3-5-10/h1-6H2,(H,9,13).
What are the key properties of 3-piperidin-1-ylimidazolidine-2,4-dione?
3-piperidin-1-ylimidazolidine-2,4-dione has a molecular weight of 183.21 g/mol, XLogP of -0.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-ylimidazolidine-2,4-dione is sourced from PubChem (CID 107842327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).