1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione

C18H22N2O5 — CID 47045320

IUPAC1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione
SMILESO=C1C(=O)N(C2CCCC2)C(=O)N1CCOCCOc1ccccc1
InChIInChI=1S/C18H22N2O5/c21-16-17(22)20(14-6-4-5-7-14)18(23)19(16)10-11-24-12-13-25-15-8-2-1-3-9-15/h1-3,8-9,14H,4-7,10-13H2
InChIKeyZFSYEJJFWKJETB-UHFFFAOYSA-N
MW346.38 g/mol
LogP1.82
Rot. Bonds8

About 1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione

1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione (PubChem CID 47045320) has the molecular formula C18H22N2O5 and a molecular weight of 346.38 g/mol. Its IUPAC name is 1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione.

Molecular Properties

Compound Name1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione
PubChem CID47045320
Molecular FormulaC18H22N2O5
Molecular Weight346.38 g/mol
Exact Mass346.15
IUPAC Name1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione
SMILESO=C1C(=O)N(C2CCCC2)C(=O)N1CCOCCOc1ccccc1
InChIInChI=1S/C18H22N2O5/c21-16-17(22)20(14-6-4-5-7-14)18(23)19(16)10-11-24-12-13-25-15-8-2-1-3-9-15/h1-3,8-9,14H,4-7,10-13H2
InChIKeyZFSYEJJFWKJETB-UHFFFAOYSA-N
XLogP1.82
TPSA76.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.38
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione 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 1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione?
The IUPAC name of 1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione (CID 47045320) is 1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione.
What is the SMILES notation for 1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione?
The canonical SMILES for 1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione is O=C1C(=O)N(C2CCCC2)C(=O)N1CCOCCOc1ccccc1.
What is the InChIKey of 1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione?
The InChIKey is ZFSYEJJFWKJETB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O5/c21-16-17(22)20(14-6-4-5-7-14)18(23)19(16)10-11-24-12-13-25-15-8-2-1-3-9-15/h1-3,8-9,14H,4-7,10-13H2.
What are the key properties of 1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione?
1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione has a molecular weight of 346.38 g/mol, XLogP of 1.82, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4,5-trione is sourced from PubChem (CID 47045320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).