5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione

C16H21ClN2O3 — CID 47772363

IUPAC5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione
SMILESCC(C)(C)OCCN1C(=O)NC(C)(c2ccc(Cl)cc2)C1=O
InChIInChI=1S/C16H21ClN2O3/c1-15(2,3)22-10-9-19-13(20)16(4,18-14(19)21)11-5-7-12(17)8-6-11/h5-8H,9-10H2,1-4H3,(H,18,21)
InChIKeyORFPKNIMZATNMN-UHFFFAOYSA-N
MW324.81 g/mol
LogP2.92
Rot. Bonds4

About 5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione

5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione (PubChem CID 47772363) has the molecular formula C16H21ClN2O3 and a molecular weight of 324.81 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione
PubChem CID47772363
Molecular FormulaC16H21ClN2O3
Molecular Weight324.81 g/mol
Exact Mass324.12
IUPAC Name5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione
SMILESCC(C)(C)OCCN1C(=O)NC(C)(c2ccc(Cl)cc2)C1=O
InChIInChI=1S/C16H21ClN2O3/c1-15(2,3)22-10-9-19-13(20)16(4,18-14(19)21)11-5-7-12(17)8-6-11/h5-8H,9-10H2,1-4H3,(H,18,21)
InChIKeyORFPKNIMZATNMN-UHFFFAOYSA-N
XLogP2.92
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.81
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione 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

3-(2-butoxyethyl)-5-(4-chlorophenyl)-5-methylimidazolidine-2,4-dione
CID 60524179
5-(4-chlorophenyl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione
CID 4671924
5-(4-chlorophenyl)-3-[2-(2,4-dichlorophenoxy)ethyl]-5-methylimidazolidine-2,4-dione
CID 4025204
(5R)-3-[2-(4-bromophenoxy)ethyl]-5-(4-chlorophenyl)-5-methylimidazolidine-2,4-dione
CID 2093930
(5R)-3-[(4-chlorophenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 2092267
5-(4-chlorophenyl)-5-methyl-3-(2-methylprop-2-enyl)imidazolidine-2,4-dione
CID 17445039
(5S)-5-(4-chlorophenyl)-3-[(2,6-dichlorophenyl)methyl]-5-methylimidazolidine-2,4-dione
CID 7907582
2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N,N-dimethylacetamide
CID 2097186
3-[2-(2,6-dichlorophenoxy)ethyl]-5-methyl-5-phenylimidazolidine-2,4-dione
CID 4826856
(5S)-5-(3,4-dichlorophenyl)-5-methyl-3-(2-propan-2-yloxyethyl)imidazolidine-2,4-dione
CID 51933134
3-(3-hydroxy-3-methylbutyl)-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 111825021
(5S)-5-(4-chlorophenyl)-5-methyl-3-[(2-methylphenyl)methyl]imidazolidine-2,4-dione
CID 2577203

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione?
The IUPAC name of 5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione (CID 47772363) is 5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione is CC(C)(C)OCCN1C(=O)NC(C)(c2ccc(Cl)cc2)C1=O.
What is the InChIKey of 5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione?
The InChIKey is ORFPKNIMZATNMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21ClN2O3/c1-15(2,3)22-10-9-19-13(20)16(4,18-14(19)21)11-5-7-12(17)8-6-11/h5-8H,9-10H2,1-4H3,(H,18,21).
What are the key properties of 5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione?
5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione has a molecular weight of 324.81 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-5-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 47772363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).