3-(2-aminoethyl)imidazolidine-2,4-dione

C5H9N3O2 — CID 10909678

IUPAC3-(2-aminoethyl)imidazolidine-2,4-dione
SMILESNCCN1C(=O)CNC1=O
InChIInChI=1S/C5H9N3O2/c6-1-2-8-4(9)3-7-5(8)10/h1-3,6H2,(H,7,10)
InChIKeyAJSRTXYBLJPMOB-UHFFFAOYSA-N
MW143.15 g/mol
LogP-1.50
Rot. Bonds2

About 3-(2-aminoethyl)imidazolidine-2,4-dione

3-(2-aminoethyl)imidazolidine-2,4-dione (PubChem CID 10909678) has the molecular formula C5H9N3O2 and a molecular weight of 143.15 g/mol. Its IUPAC name is 3-(2-aminoethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(2-aminoethyl)imidazolidine-2,4-dione
PubChem CID10909678
Molecular FormulaC5H9N3O2
Molecular Weight143.15 g/mol
Exact Mass143.07
IUPAC Name3-(2-aminoethyl)imidazolidine-2,4-dione
SMILESNCCN1C(=O)CNC1=O
InChIInChI=1S/C5H9N3O2/c6-1-2-8-4(9)3-7-5(8)10/h1-3,6H2,(H,7,10)
InChIKeyAJSRTXYBLJPMOB-UHFFFAOYSA-N
XLogP-1.50
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.15
LogP ≤ 5-1.50
H-Bond Donors ≤ 52
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-(2-aminoethyl)imidazolidine-2,4-dione?
The IUPAC name of 3-(2-aminoethyl)imidazolidine-2,4-dione (CID 10909678) is 3-(2-aminoethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(2-aminoethyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(2-aminoethyl)imidazolidine-2,4-dione is NCCN1C(=O)CNC1=O.
What is the InChIKey of 3-(2-aminoethyl)imidazolidine-2,4-dione?
The InChIKey is AJSRTXYBLJPMOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O2/c6-1-2-8-4(9)3-7-5(8)10/h1-3,6H2,(H,7,10).
What are the key properties of 3-(2-aminoethyl)imidazolidine-2,4-dione?
3-(2-aminoethyl)imidazolidine-2,4-dione has a molecular weight of 143.15 g/mol, XLogP of -1.50, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 10909678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).