3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione

C25H32N2O5 — CID 18204838

IUPAC3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione
SMILESCOc1ccc(CCC2(C)NC(=O)N(CC(O)COc3ccccc3C(C)C)C2=O)cc1
InChIInChI=1S/C25H32N2O5/c1-17(2)21-7-5-6-8-22(21)32-16-19(28)15-27-23(29)25(3,26-24(27)30)14-13-18-9-11-20(31-4)12-10-18/h5-12,17,19,28H,13-16H2,1-4H3,(H,26,30)
InChIKeyGILFOJMFLXNELM-UHFFFAOYSA-N
MW440.54 g/mol
LogP3.50
Rot. Bonds10

About 3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione

3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione (PubChem CID 18204838) has the molecular formula C25H32N2O5 and a molecular weight of 440.54 g/mol. Its IUPAC name is 3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione
PubChem CID18204838
Molecular FormulaC25H32N2O5
Molecular Weight440.54 g/mol
Exact Mass440.23
IUPAC Name3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione
SMILESCOc1ccc(CCC2(C)NC(=O)N(CC(O)COc3ccccc3C(C)C)C2=O)cc1
InChIInChI=1S/C25H32N2O5/c1-17(2)21-7-5-6-8-22(21)32-16-19(28)15-27-23(29)25(3,26-24(27)30)14-13-18-9-11-20(31-4)12-10-18/h5-12,17,19,28H,13-16H2,1-4H3,(H,26,30)
InChIKeyGILFOJMFLXNELM-UHFFFAOYSA-N
XLogP3.50
TPSA88.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.54
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-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

5,5-diethyl-3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]imidazolidine-2,4-dione
CID 18086989
(5S)-5-[2-(4-methoxyphenyl)ethyl]-5-methyl-3-(2-phenoxyethyl)imidazolidine-2,4-dione
CID 8506760
(5R)-5-[2-(4-methoxyphenyl)ethyl]-5-methyl-3-phenacylimidazolidine-2,4-dione
CID 8507246
benzyl-[[(4S)-4-[2-(4-methoxyphenyl)ethyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]methyl]-methylazanium
CID 9169331
2-[(4R)-4-[2-(4-methoxyphenyl)ethyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]-N,N-di(propan-2-yl)acetamide
CID 8506922
2-[(4S)-4-[2-(4-methoxyphenyl)ethyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-propan-2-ylacetamide
CID 8506856
(5R)-3-[(2R)-2-hydroxy-3-phenoxypropyl]-5-methyl-5-propylimidazolidine-2,4-dione
CID 94389630
2-[(4S)-4-[2-(4-methoxyphenyl)ethyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2-phenylethyl)acetamide
CID 8507184
(5S)-5-[2-(4-methoxyphenyl)ethyl]-5-methyl-3-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]imidazolidine-2,4-dione
CID 8507218
2-[(4R)-4-[2-(4-methoxyphenyl)ethyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(2-methoxyphenyl)methyl]acetamide
CID 8507081
(5R)-5-[2-(4-methoxyphenyl)ethyl]-5-methyl-3-[(2-methylphenyl)methyl]imidazolidine-2,4-dione
CID 8507004
5-butyl-3-[3-(4-ethylphenoxy)-2-hydroxypropyl]-5-methylimidazolidine-2,4-dione
CID 18086975

Frequently Asked Questions

What is the IUPAC name of 3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione?
The IUPAC name of 3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione (CID 18204838) is 3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione?
The canonical SMILES for 3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione is COc1ccc(CCC2(C)NC(=O)N(CC(O)COc3ccccc3C(C)C)C2=O)cc1.
What is the InChIKey of 3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione?
The InChIKey is GILFOJMFLXNELM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N2O5/c1-17(2)21-7-5-6-8-22(21)32-16-19(28)15-27-23(29)25(3,26-24(27)30)14-13-18-9-11-20(31-4)12-10-18/h5-12,17,19,28H,13-16H2,1-4H3,(H,26,30).
What are the key properties of 3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione?
3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione has a molecular weight of 440.54 g/mol, XLogP of 3.50, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-5-[2-(4-methoxyphenyl)ethyl]-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 18204838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).