3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione

C21H18N2O3 — CID 84571228

IUPAC3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)C(=O)N1CCOc1cccc2ccccc12
InChIInChI=1S/C21H18N2O3/c24-20-19(16-8-2-1-3-9-16)22-21(25)23(20)13-14-26-18-12-6-10-15-7-4-5-11-17(15)18/h1-12,19H,13-14H2,(H,22,25)
InChIKeyPAMGIHNJEKUTJB-UHFFFAOYSA-N
MW346.39 g/mol
LogP3.51
Rot. Bonds5

About 3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione

3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione (PubChem CID 84571228) has the molecular formula C21H18N2O3 and a molecular weight of 346.39 g/mol. Its IUPAC name is 3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione
PubChem CID84571228
Molecular FormulaC21H18N2O3
Molecular Weight346.39 g/mol
Exact Mass346.13
IUPAC Name3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)C(=O)N1CCOc1cccc2ccccc12
InChIInChI=1S/C21H18N2O3/c24-20-19(16-8-2-1-3-9-16)22-21(25)23(20)13-14-26-18-12-6-10-15-7-4-5-11-17(15)18/h1-12,19H,13-14H2,(H,22,25)
InChIKeyPAMGIHNJEKUTJB-UHFFFAOYSA-N
XLogP3.51
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 53.51
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 3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione (CID 84571228) is 3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione is O=C1NC(c2ccccc2)C(=O)N1CCOc1cccc2ccccc12.
What is the InChIKey of 3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione?
The InChIKey is PAMGIHNJEKUTJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O3/c24-20-19(16-8-2-1-3-9-16)22-21(25)23(20)13-14-26-18-12-6-10-15-7-4-5-11-17(15)18/h1-12,19H,13-14H2,(H,22,25).
What are the key properties of 3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione?
3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione has a molecular weight of 346.39 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-naphthalen-1-yloxyethyl)-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 84571228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).