[2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium

C21H24N3O4+ — CID 54027160

IUPAC[2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium
SMILESC[N+](C)(C)CC(=O)OCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C21H23N3O4/c1-24(2,3)14-18(25)28-15-23-19(26)21(22-20(23)27,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3/p+1
InChIKeyNISGPMBYCFNCAK-UHFFFAOYSA-O
MW382.44 g/mol
LogP1.69
Rot. Bonds6

About [2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium

[2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium (PubChem CID 54027160) has the molecular formula C21H24N3O4+ and a molecular weight of 382.44 g/mol. Its IUPAC name is [2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium.

Molecular Properties

Compound Name[2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium
PubChem CID54027160
Molecular FormulaC21H24N3O4+
Molecular Weight382.44 g/mol
Exact Mass382.18
IUPAC Name[2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium
SMILESC[N+](C)(C)CC(=O)OCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C21H23N3O4/c1-24(2,3)14-18(25)28-15-23-19(26)21(22-20(23)27,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3/p+1
InChIKeyNISGPMBYCFNCAK-UHFFFAOYSA-O
XLogP1.69
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Analyze [2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium 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

(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl 2,2,2-trichloroethanimidate
CID 23650796
(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy-oxophosphanium
CID 173376528
3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione
CID 51108463
ethyl 2-[2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)ethoxy]acetate
CID 75425557
S-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl] 2-aminoethanethioate
CID 54266354
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 2117749
3-hexyl-5,5-diphenylimidazolidine-2,4-dione
CID 24860362
3-decyl-5,5-diphenylimidazolidine-2,4-dione
CID 11696827
(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl (2R)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
CID 10257300
3-[2-(2-methylimidazol-1-yl)ethyl]-5,5-diphenylimidazolidine-2,4-dione
CID 75399916
(5-methyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl)methyl propanoate
CID 14983740
2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid
CID 3084726

Frequently Asked Questions

What is the IUPAC name of [2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium?
The IUPAC name of [2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium (CID 54027160) is [2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium.
What is the SMILES notation for [2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium?
The canonical SMILES for [2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium is C[N+](C)(C)CC(=O)OCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O.
What is the InChIKey of [2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium?
The InChIKey is NISGPMBYCFNCAK-UHFFFAOYSA-O. The full InChI is InChI=1S/C21H23N3O4/c1-24(2,3)14-18(25)28-15-23-19(26)21(22-20(23)27,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3/p+1.
What are the key properties of [2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium?
[2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium has a molecular weight of 382.44 g/mol, XLogP of 1.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy]-2-oxoethyl]-trimethylazanium is sourced from PubChem (CID 54027160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).