3-amino-5-phenylimidazolidine-2,4-dione

C9H9N3O2 — CID 22137735

IUPAC3-amino-5-phenylimidazolidine-2,4-dione
SMILESNN1C(=O)NC(c2ccccc2)C1=O
InChIInChI=1S/C9H9N3O2/c10-12-8(13)7(11-9(12)14)6-4-2-1-3-5-6/h1-5,7H,10H2,(H,11,14)
InChIKeyYUWYTLLYSHCFOT-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.15
Rot. Bonds1

About 3-amino-5-phenylimidazolidine-2,4-dione

3-amino-5-phenylimidazolidine-2,4-dione (PubChem CID 22137735) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is 3-amino-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-amino-5-phenylimidazolidine-2,4-dione
PubChem CID22137735
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name3-amino-5-phenylimidazolidine-2,4-dione
SMILESNN1C(=O)NC(c2ccccc2)C1=O
InChIInChI=1S/C9H9N3O2/c10-12-8(13)7(11-9(12)14)6-4-2-1-3-5-6/h1-5,7H,10H2,(H,11,14)
InChIKeyYUWYTLLYSHCFOT-UHFFFAOYSA-N
XLogP0.15
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 ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-amino-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 3-amino-5-phenylimidazolidine-2,4-dione (CID 22137735) is 3-amino-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-amino-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 3-amino-5-phenylimidazolidine-2,4-dione is NN1C(=O)NC(c2ccccc2)C1=O.
What is the InChIKey of 3-amino-5-phenylimidazolidine-2,4-dione?
The InChIKey is YUWYTLLYSHCFOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c10-12-8(13)7(11-9(12)14)6-4-2-1-3-5-6/h1-5,7H,10H2,(H,11,14).
What are the key properties of 3-amino-5-phenylimidazolidine-2,4-dione?
3-amino-5-phenylimidazolidine-2,4-dione has a molecular weight of 191.19 g/mol, XLogP of 0.15, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 22137735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).