ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate

C23H24N2O6 — CID 3155071

IUPACethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate
SMILESCCOC(=O)CN1C(=O)N(CC(=O)OCC)C(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C23H24N2O6/c1-3-30-19(26)15-24-21(28)23(17-11-7-5-8-12-17,18-13-9-6-10-14-18)25(22(24)29)16-20(27)31-4-2/h5-14H,3-4,15-16H2,1-2H3
InChIKeyPYEWXOLVEZYTRC-UHFFFAOYSA-N
MW424.45 g/mol
LogP2.32
Rot. Bonds8

About ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate

ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate (PubChem CID 3155071) has the molecular formula C23H24N2O6 and a molecular weight of 424.45 g/mol. Its IUPAC name is ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate
PubChem CID3155071
Molecular FormulaC23H24N2O6
Molecular Weight424.45 g/mol
Exact Mass424.16
IUPAC Nameethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate
SMILESCCOC(=O)CN1C(=O)N(CC(=O)OCC)C(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C23H24N2O6/c1-3-30-19(26)15-24-21(28)23(17-11-7-5-8-12-17,18-13-9-6-10-14-18)25(22(24)29)16-20(27)31-4-2/h5-14H,3-4,15-16H2,1-2H3
InChIKeyPYEWXOLVEZYTRC-UHFFFAOYSA-N
XLogP2.32
TPSA93.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.45
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate 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 ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate?
The IUPAC name of ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate (CID 3155071) is ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate.
What is the SMILES notation for ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate?
The canonical SMILES for ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate is CCOC(=O)CN1C(=O)N(CC(=O)OCC)C(c2ccccc2)(c2ccccc2)C1=O.
What is the InChIKey of ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate?
The InChIKey is PYEWXOLVEZYTRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O6/c1-3-30-19(26)15-24-21(28)23(17-11-7-5-8-12-17,18-13-9-6-10-14-18)25(22(24)29)16-20(27)31-4-2/h5-14H,3-4,15-16H2,1-2H3.
What are the key properties of ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate?
ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate has a molecular weight of 424.45 g/mol, XLogP of 2.32, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate is sourced from PubChem (CID 3155071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).