3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide

C25H23N3O3 — CID 52727040

IUPAC3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cccc(CN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)c1
InChIInChI=1S/C25H23N3O3/c1-27(2)22(29)19-11-9-10-18(16-19)17-28-23(30)25(26-24(28)31,20-12-5-3-6-13-20)21-14-7-4-8-15-21/h3-16H,17H2,1-2H3,(H,26,31)
InChIKeyUJGBUDYTRPHDMB-UHFFFAOYSA-N
MW413.48 g/mol
LogP3.38
Rot. Bonds5

About 3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide

3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide (PubChem CID 52727040) has the molecular formula C25H23N3O3 and a molecular weight of 413.48 g/mol. Its IUPAC name is 3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide
PubChem CID52727040
Molecular FormulaC25H23N3O3
Molecular Weight413.48 g/mol
Exact Mass413.17
IUPAC Name3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cccc(CN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)c1
InChIInChI=1S/C25H23N3O3/c1-27(2)22(29)19-11-9-10-18(16-19)17-28-23(30)25(26-24(28)31,20-12-5-3-6-13-20)21-14-7-4-8-15-21/h3-16H,17H2,1-2H3,(H,26,31)
InChIKeyUJGBUDYTRPHDMB-UHFFFAOYSA-N
XLogP3.38
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.48
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzenesulfonamide
CID 4794115
3-[(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]benzamide
CID 55631679
3-[(4-methylphenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
CID 4810451
3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
CID 78797815
N-(furan-2-ylmethyl)-3-[(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]benzamide
CID 60529812
3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione
CID 51108463
3-[(4-methyl-2,5-dioxo-4-pyridin-2-ylimidazolidin-1-yl)methyl]benzoic acid
CID 82148005
3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-methyl-N-(1-phenylethyl)benzamide
CID 155059056
3-(naphthalen-1-ylmethyl)-5,5-diphenylimidazolidine-2,4-dione
CID 7916945
(5S)-3-(1,3-benzodioxol-5-ylmethyl)-5-(3,4-dimethylphenyl)-5-phenylimidazolidine-2,4-dione
CID 9291310
N,N-dimethyl-3-(methylaminomethyl)benzamide
CID 83814364
N,N-dimethyl-2-(5-oxo-4,4-diphenyl-2-sulfanylideneimidazolidin-1-yl)acetamide
CID 11199004

Frequently Asked Questions

What is the IUPAC name of 3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide?
The IUPAC name of 3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide (CID 52727040) is 3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide.
What is the SMILES notation for 3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide?
The canonical SMILES for 3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide is CN(C)C(=O)c1cccc(CN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)c1.
What is the InChIKey of 3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide?
The InChIKey is UJGBUDYTRPHDMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O3/c1-27(2)22(29)19-11-9-10-18(16-19)17-28-23(30)25(26-24(28)31,20-12-5-3-6-13-20)21-14-7-4-8-15-21/h3-16H,17H2,1-2H3,(H,26,31).
What are the key properties of 3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide?
3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide has a molecular weight of 413.48 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide is sourced from PubChem (CID 52727040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).