5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione

C15H20N2O3 — CID 31571808

IUPAC5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione
SMILESCCC1(CC)NC(=O)N(C[C@@H](O)c2ccccc2)C1=O
InChIInChI=1S/C15H20N2O3/c1-3-15(4-2)13(19)17(14(20)16-15)10-12(18)11-8-6-5-7-9-11/h5-9,12,18H,3-4,10H2,1-2H3,(H,16,20)/t12-/m1/s1
InChIKeyMUPDOICDHMGGOB-GFCCVEGCSA-N
MW276.34 g/mol
LogP1.83
Rot. Bonds5

About 5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione

5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione (PubChem CID 31571808) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione
PubChem CID31571808
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione
SMILESCCC1(CC)NC(=O)N(C[C@@H](O)c2ccccc2)C1=O
InChIInChI=1S/C15H20N2O3/c1-3-15(4-2)13(19)17(14(20)16-15)10-12(18)11-8-6-5-7-9-11/h5-9,12,18H,3-4,10H2,1-2H3,(H,16,20)/t12-/m1/s1
InChIKeyMUPDOICDHMGGOB-GFCCVEGCSA-N
XLogP1.83
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5,5-diethyl-3-[(2R)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione
CID 31571809
5,5-diethyl-3-[2-hydroxy-2-(4-methylphenyl)ethyl]imidazolidine-2,4-dione
CID 111476311
5,5-diethyl-3-[2-hydroxy-2-[3-(trifluoromethyl)phenyl]ethyl]imidazolidine-2,4-dione
CID 51086545
5-ethyl-5-(4-fluorophenyl)-3-(2-hydroxy-2-phenylethyl)imidazolidine-2,4-dione
CID 17454359
5,5-diethyl-3-[(2R)-2-hydroxy-3-[(S)-(2-methylphenyl)-phenylmethoxy]propyl]imidazolidine-2,4-dione
CID 31571826
N-benzhydryl-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 2425467
5-(4-chlorophenyl)-3-(2-hydroxy-2-phenylethyl)-5-methylimidazolidine-2,4-dione
CID 17478863
5,5-diethyl-3-[2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]imidazolidine-2,4-dione
CID 18086989
3-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-5,5-diphenylimidazolidine-2,4-dione
CID 32519552
5-ethyl-5-(4-fluorophenyl)-3-[2-(4-fluorophenyl)-2-hydroxyethyl]imidazolidine-2,4-dione
CID 42938170
(4S)-3'-[(2S)-2-hydroxy-2-phenylethyl]spiro[2,3-dihydro-1H-naphthalene-4,5'-imidazolidine]-2',4'-dione
CID 94184393
3-[(2S)-2-(4-fluorophenyl)-2-hydroxyethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 32519562

Frequently Asked Questions

What is the IUPAC name of 5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione?
The IUPAC name of 5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione (CID 31571808) is 5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione?
The canonical SMILES for 5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione is CCC1(CC)NC(=O)N(C[C@@H](O)c2ccccc2)C1=O.
What is the InChIKey of 5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione?
The InChIKey is MUPDOICDHMGGOB-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-3-15(4-2)13(19)17(14(20)16-15)10-12(18)11-8-6-5-7-9-11/h5-9,12,18H,3-4,10H2,1-2H3,(H,16,20)/t12-/m1/s1.
What are the key properties of 5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione?
5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione has a molecular weight of 276.34 g/mol, XLogP of 1.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diethyl-3-[(2S)-2-hydroxy-2-phenylethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 31571808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).