3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione

C8H5Cl2N3O2 — CID 142231712

IUPAC3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1c1cc(Cl)nc(Cl)c1
InChIInChI=1S/C8H5Cl2N3O2/c9-5-1-4(2-6(10)12-5)13-7(14)3-11-8(13)15/h1-2H,3H2,(H,11,15)
InChIKeyUQIPJPSGZNLNAG-UHFFFAOYSA-N
MW246.05 g/mol
LogP1.44
Rot. Bonds1

About 3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione

3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione (PubChem CID 142231712) has the molecular formula C8H5Cl2N3O2 and a molecular weight of 246.05 g/mol. Its IUPAC name is 3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione
PubChem CID142231712
Molecular FormulaC8H5Cl2N3O2
Molecular Weight246.05 g/mol
Exact Mass244.98
IUPAC Name3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1c1cc(Cl)nc(Cl)c1
InChIInChI=1S/C8H5Cl2N3O2/c9-5-1-4(2-6(10)12-5)13-7(14)3-11-8(13)15/h1-2H,3H2,(H,11,15)
InChIKeyUQIPJPSGZNLNAG-UHFFFAOYSA-N
XLogP1.44
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.05
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze 3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione?
The IUPAC name of 3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione (CID 142231712) is 3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione is O=C1CNC(=O)N1c1cc(Cl)nc(Cl)c1.
What is the InChIKey of 3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione?
The InChIKey is UQIPJPSGZNLNAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5Cl2N3O2/c9-5-1-4(2-6(10)12-5)13-7(14)3-11-8(13)15/h1-2H,3H2,(H,11,15).
What are the key properties of 3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione?
3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione has a molecular weight of 246.05 g/mol, XLogP of 1.44, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-dichloro-4-pyridinyl)imidazolidine-2,4-dione is sourced from PubChem (CID 142231712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).