2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide

C25H23N3O5 — CID 4801230

IUPAC2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide
SMILESCOc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(CC(=O)Nc3ccccc3)C2=O)cc1
InChIInChI=1S/C25H23N3O5/c1-32-20-12-8-17(9-13-20)25(18-10-14-21(33-2)15-11-18)23(30)28(24(31)27-25)16-22(29)26-19-6-4-3-5-7-19/h3-15H,16H2,1-2H3,(H,26,29)(H,27,31)
InChIKeyPTTKCQLEWAKKDU-UHFFFAOYSA-N
MW445.48 g/mol
LogP3.14
Rot. Bonds7

About 2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide

2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide (PubChem CID 4801230) has the molecular formula C25H23N3O5 and a molecular weight of 445.48 g/mol. Its IUPAC name is 2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide
PubChem CID4801230
Molecular FormulaC25H23N3O5
Molecular Weight445.48 g/mol
Exact Mass445.16
IUPAC Name2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide
SMILESCOc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(CC(=O)Nc3ccccc3)C2=O)cc1
InChIInChI=1S/C25H23N3O5/c1-32-20-12-8-17(9-13-20)25(18-10-14-21(33-2)15-11-18)23(30)28(24(31)27-25)16-22(29)26-19-6-4-3-5-7-19/h3-15H,16H2,1-2H3,(H,26,29)(H,27,31)
InChIKeyPTTKCQLEWAKKDU-UHFFFAOYSA-N
XLogP3.14
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500445.48
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide 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-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide?
The IUPAC name of 2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide (CID 4801230) is 2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide.
What is the SMILES notation for 2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide?
The canonical SMILES for 2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide is COc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(CC(=O)Nc3ccccc3)C2=O)cc1.
What is the InChIKey of 2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide?
The InChIKey is PTTKCQLEWAKKDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O5/c1-32-20-12-8-17(9-13-20)25(18-10-14-21(33-2)15-11-18)23(30)28(24(31)27-25)16-22(29)26-19-6-4-3-5-7-19/h3-15H,16H2,1-2H3,(H,26,29)(H,27,31).
What are the key properties of 2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide?
2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide has a molecular weight of 445.48 g/mol, XLogP of 3.14, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide is sourced from PubChem (CID 4801230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).