1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione

C11H13N3O2 — CID 106760963

IUPAC1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione
SMILESCN(C)c1ccccc1N1CC(=O)NC1=O
InChIInChI=1S/C11H13N3O2/c1-13(2)8-5-3-4-6-9(8)14-7-10(15)12-11(14)16/h3-6H,7H2,1-2H3,(H,12,15,16)
InChIKeyTXKAWJSKMPCZBU-UHFFFAOYSA-N
MW219.24 g/mol
LogP0.81
Rot. Bonds2

About 1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione

1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione (PubChem CID 106760963) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is 1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione
PubChem CID106760963
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC Name1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione
SMILESCN(C)c1ccccc1N1CC(=O)NC1=O
InChIInChI=1S/C11H13N3O2/c1-13(2)8-5-3-4-6-9(8)14-7-10(15)12-11(14)16/h3-6H,7H2,1-2H3,(H,12,15,16)
InChIKeyTXKAWJSKMPCZBU-UHFFFAOYSA-N
XLogP0.81
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 50.81
H-Bond Donors ≤ 51
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 1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione?
The IUPAC name of 1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione (CID 106760963) is 1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione.
What is the SMILES notation for 1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione?
The canonical SMILES for 1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione is CN(C)c1ccccc1N1CC(=O)NC1=O.
What is the InChIKey of 1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione?
The InChIKey is TXKAWJSKMPCZBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2/c1-13(2)8-5-3-4-6-9(8)14-7-10(15)12-11(14)16/h3-6H,7H2,1-2H3,(H,12,15,16).
What are the key properties of 1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione?
1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione has a molecular weight of 219.24 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)phenyl]imidazolidine-2,4-dione is sourced from PubChem (CID 106760963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).