1-(2-aminophenyl)imidazolidine-2,4-dione

C9H9N3O2 — CID 83818017

IUPAC1-(2-aminophenyl)imidazolidine-2,4-dione
SMILESNc1ccccc1N1CC(=O)NC1=O
InChIInChI=1S/C9H9N3O2/c10-6-3-1-2-4-7(6)12-5-8(13)11-9(12)14/h1-4H,5,10H2,(H,11,13,14)
InChIKeyMZMKHHCVGISYJN-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.32
Rot. Bonds1

About 1-(2-aminophenyl)imidazolidine-2,4-dione

1-(2-aminophenyl)imidazolidine-2,4-dione (PubChem CID 83818017) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is 1-(2-aminophenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(2-aminophenyl)imidazolidine-2,4-dione
PubChem CID83818017
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name1-(2-aminophenyl)imidazolidine-2,4-dione
SMILESNc1ccccc1N1CC(=O)NC1=O
InChIInChI=1S/C9H9N3O2/c10-6-3-1-2-4-7(6)12-5-8(13)11-9(12)14/h1-4H,5,10H2,(H,11,13,14)
InChIKeyMZMKHHCVGISYJN-UHFFFAOYSA-N
XLogP0.32
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2-aminophenyl)imidazolidine-2,4-dione?
The IUPAC name of 1-(2-aminophenyl)imidazolidine-2,4-dione (CID 83818017) is 1-(2-aminophenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 1-(2-aminophenyl)imidazolidine-2,4-dione?
The canonical SMILES for 1-(2-aminophenyl)imidazolidine-2,4-dione is Nc1ccccc1N1CC(=O)NC1=O.
What is the InChIKey of 1-(2-aminophenyl)imidazolidine-2,4-dione?
The InChIKey is MZMKHHCVGISYJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c10-6-3-1-2-4-7(6)12-5-8(13)11-9(12)14/h1-4H,5,10H2,(H,11,13,14).
What are the key properties of 1-(2-aminophenyl)imidazolidine-2,4-dione?
1-(2-aminophenyl)imidazolidine-2,4-dione has a molecular weight of 191.19 g/mol, XLogP of 0.32, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminophenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 83818017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).