3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione

C20H16N4O2 — CID 69242113

IUPAC3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1C1CC1c1ccc(-c2cccc3ncccc23)nc1
InChIInChI=1S/C20H16N4O2/c25-19-11-23-20(26)24(19)18-9-15(18)12-6-7-17(22-10-12)13-3-1-5-16-14(13)4-2-8-21-16/h1-8,10,15,18H,9,11H2,(H,23,26)
InChIKeyORQGFXAWPGQJRH-UHFFFAOYSA-N
MW344.37 g/mol
LogP2.70
Rot. Bonds3

About 3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione

3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione (PubChem CID 69242113) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is 3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione
PubChem CID69242113
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC Name3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1C1CC1c1ccc(-c2cccc3ncccc23)nc1
InChIInChI=1S/C20H16N4O2/c25-19-11-23-20(26)24(19)18-9-15(18)12-6-7-17(22-10-12)13-3-1-5-16-14(13)4-2-8-21-16/h1-8,10,15,18H,9,11H2,(H,23,26)
InChIKeyORQGFXAWPGQJRH-UHFFFAOYSA-N
XLogP2.70
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]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-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione?
The IUPAC name of 3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione (CID 69242113) is 3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione?
The canonical SMILES for 3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione is O=C1CNC(=O)N1C1CC1c1ccc(-c2cccc3ncccc23)nc1.
What is the InChIKey of 3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione?
The InChIKey is ORQGFXAWPGQJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c25-19-11-23-20(26)24(19)18-9-15(18)12-6-7-17(22-10-12)13-3-1-5-16-14(13)4-2-8-21-16/h1-8,10,15,18H,9,11H2,(H,23,26).
What are the key properties of 3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione?
3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione has a molecular weight of 344.37 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(6-quinolin-5-yl-3-pyridinyl)cyclopropyl]imidazolidine-2,4-dione is sourced from PubChem (CID 69242113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).