1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione

C11H12ClN3O2 — CID 141300308

IUPAC1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione
SMILESCC1(C)C(=O)NC(=O)N1c1ccc(N)cc1Cl
InChIInChI=1S/C11H12ClN3O2/c1-11(2)9(16)14-10(17)15(11)8-4-3-6(13)5-7(8)12/h3-5H,13H2,1-2H3,(H,14,16,17)
InChIKeyFKFQKPLFRCWEEW-UHFFFAOYSA-N
MW253.69 g/mol
LogP1.76
Rot. Bonds1

About 1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione

1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 141300308) has the molecular formula C11H12ClN3O2 and a molecular weight of 253.69 g/mol. Its IUPAC name is 1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione
PubChem CID141300308
Molecular FormulaC11H12ClN3O2
Molecular Weight253.69 g/mol
Exact Mass253.06
IUPAC Name1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione
SMILESCC1(C)C(=O)NC(=O)N1c1ccc(N)cc1Cl
InChIInChI=1S/C11H12ClN3O2/c1-11(2)9(16)14-10(17)15(11)8-4-3-6(13)5-7(8)12/h3-5H,13H2,1-2H3,(H,14,16,17)
InChIKeyFKFQKPLFRCWEEW-UHFFFAOYSA-N
XLogP1.76
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.69
LogP ≤ 51.76
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-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione (CID 141300308) is 1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione is CC1(C)C(=O)NC(=O)N1c1ccc(N)cc1Cl.
What is the InChIKey of 1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is FKFQKPLFRCWEEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN3O2/c1-11(2)9(16)14-10(17)15(11)8-4-3-6(13)5-7(8)12/h3-5H,13H2,1-2H3,(H,14,16,17).
What are the key properties of 1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione?
1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 253.69 g/mol, XLogP of 1.76, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-2-chlorophenyl)-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 141300308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).