N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide

C20H25N3O6 — CID 8606430

IUPACN-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide
SMILESCCOc1ccc(N2C(=O)C(=O)N(CC(=O)NC3CCCC3)C2=O)cc1OCC
InChIInChI=1S/C20H25N3O6/c1-3-28-15-10-9-14(11-16(15)29-4-2)23-19(26)18(25)22(20(23)27)12-17(24)21-13-7-5-6-8-13/h9-11,13H,3-8,12H2,1-2H3,(H,21,24)
InChIKeyZTPBLRUTDDOCJO-UHFFFAOYSA-N
MW403.44 g/mol
LogP1.84
Rot. Bonds8

About N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide

N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide (PubChem CID 8606430) has the molecular formula C20H25N3O6 and a molecular weight of 403.44 g/mol. Its IUPAC name is N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide
PubChem CID8606430
Molecular FormulaC20H25N3O6
Molecular Weight403.44 g/mol
Exact Mass403.17
IUPAC NameN-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide
SMILESCCOc1ccc(N2C(=O)C(=O)N(CC(=O)NC3CCCC3)C2=O)cc1OCC
InChIInChI=1S/C20H25N3O6/c1-3-28-15-10-9-14(11-16(15)29-4-2)23-19(26)18(25)22(20(23)27)12-17(24)21-13-7-5-6-8-13/h9-11,13H,3-8,12H2,1-2H3,(H,21,24)
InChIKeyZTPBLRUTDDOCJO-UHFFFAOYSA-N
XLogP1.84
TPSA105.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.44
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-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

Related Compounds

2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide
CID 40942047
2-[3-(3,4-dipropoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]-N-methylacetamide
CID 8607579
2-[3-(4-methoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 7491808
N-cycloheptyl-3-(3,4-diethoxyphenyl)propanamide
CID 99949717
N-[2-(cyclopentylamino)-2-oxoethyl]-3,4-diethoxybenzamide
CID 26697465
N-cyclopentyl-2-(2,4,5-trioxo-3-propan-2-ylimidazolidin-1-yl)acetamide
CID 7975978
N-cyclohexyl-3,4-diethoxybenzamide
CID 917356
N-(3,4-diethoxyphenyl)-2-(2,4,5-trioxo-3-propan-2-ylimidazolidin-1-yl)acetamide
CID 7975817
N-cyclooctyl-2-[3-(2-methylpropyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide
CID 2574753
2-(4-cyano-2-ethoxyphenoxy)-N-cyclopentylacetamide
CID 7993285
1-(3,4-diethoxyphenyl)-3-[(4-nitrophenyl)methyl]imidazolidine-2,4,5-trione
CID 8606393
N-cyclohexyl-2-(2-ethoxyphenoxy)acetamide
CID 731871

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide (CID 8606430) is N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide is CCOc1ccc(N2C(=O)C(=O)N(CC(=O)NC3CCCC3)C2=O)cc1OCC.
What is the InChIKey of N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide?
The InChIKey is ZTPBLRUTDDOCJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O6/c1-3-28-15-10-9-14(11-16(15)29-4-2)23-19(26)18(25)22(20(23)27)12-17(24)21-13-7-5-6-8-13/h9-11,13H,3-8,12H2,1-2H3,(H,21,24).
What are the key properties of N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide?
N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide has a molecular weight of 403.44 g/mol, XLogP of 1.84, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[3-(3,4-diethoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 8606430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).