2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide

C23H21N3O5 — CID 16551186

IUPAC2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide
SMILESCCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc3c(C)cc(=O)oc3c2)C1=O
InChIInChI=1S/C23H21N3O5/c1-3-23(15-7-5-4-6-8-15)21(29)26(22(30)25-23)13-19(27)24-16-9-10-17-14(2)11-20(28)31-18(17)12-16/h4-12H,3,13H2,1-2H3,(H,24,27)(H,25,30)
InChIKeySXNULUFYXQJELK-UHFFFAOYSA-N
MW419.44 g/mol
LogP2.90
Rot. Bonds5

About 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide

2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide (PubChem CID 16551186) has the molecular formula C23H21N3O5 and a molecular weight of 419.44 g/mol. Its IUPAC name is 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide.

Molecular Properties

Compound Name2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide
PubChem CID16551186
Molecular FormulaC23H21N3O5
Molecular Weight419.44 g/mol
Exact Mass419.15
IUPAC Name2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide
SMILESCCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc3c(C)cc(=O)oc3c2)C1=O
InChIInChI=1S/C23H21N3O5/c1-3-23(15-7-5-4-6-8-15)21(29)26(22(30)25-23)13-19(27)24-16-9-10-17-14(2)11-20(28)31-18(17)12-16/h4-12H,3,13H2,1-2H3,(H,24,27)(H,25,30)
InChIKeySXNULUFYXQJELK-UHFFFAOYSA-N
XLogP2.90
TPSA108.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.44
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide 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 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide?
The IUPAC name of 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide (CID 16551186) is 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide.
What is the SMILES notation for 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide?
The canonical SMILES for 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide is CCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc3c(C)cc(=O)oc3c2)C1=O.
What is the InChIKey of 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide?
The InChIKey is SXNULUFYXQJELK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O5/c1-3-23(15-7-5-4-6-8-15)21(29)26(22(30)25-23)13-19(27)24-16-9-10-17-14(2)11-20(28)31-18(17)12-16/h4-12H,3,13H2,1-2H3,(H,24,27)(H,25,30).
What are the key properties of 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide?
2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide has a molecular weight of 419.44 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-methyl-2-oxochromen-7-yl)acetamide is sourced from PubChem (CID 16551186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).