(5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione

C18H18N2O2 — CID 51463779

IUPAC(5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
SMILESCc1ccc([C@]2(C)NC(=O)N(Cc3ccccc3)C2=O)cc1
InChIInChI=1S/C18H18N2O2/c1-13-8-10-15(11-9-13)18(2)16(21)20(17(22)19-18)12-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3,(H,19,22)/t18-/m0/s1
InChIKeySYNOQTRUURZHEA-SFHVURJKSA-N
MW294.35 g/mol
LogP2.96
Rot. Bonds3

About (5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione

(5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione (PubChem CID 51463779) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is (5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
PubChem CID51463779
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name(5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
SMILESCc1ccc([C@]2(C)NC(=O)N(Cc3ccccc3)C2=O)cc1
InChIInChI=1S/C18H18N2O2/c1-13-8-10-15(11-9-13)18(2)16(21)20(17(22)19-18)12-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3,(H,19,22)/t18-/m0/s1
InChIKeySYNOQTRUURZHEA-SFHVURJKSA-N
XLogP2.96
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(5R)-3-[(4-chlorophenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 2092267
5-methyl-3-[[4-(4-methylphenyl)sulfonylphenyl]methyl]-5-phenylimidazolidine-2,4-dione
CID 46435513
(5S)-5-methyl-3-[(3-methylphenyl)methyl]-5-phenylimidazolidine-2,4-dione
CID 7177858
3-[(4-tert-butylphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 4084225
3-[(4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 16577297
4-[[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide
CID 4877614
4-[[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]methyl]benzonitrile
CID 5010389
5-(4-fluorophenyl)-5-methyl-3-[(3-methylphenyl)methyl]imidazolidine-2,4-dione
CID 51259391
N,N-dimethyl-4-[[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]methyl]benzamide
CID 84601218
3-[[4-(difluoromethylsulfonyl)phenyl]methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 78827274
(5S)-3-benzyl-5-(3-bromophenyl)-5-methylimidazolidine-2,4-dione
CID 7178046
3-benzyl-5-(3-bromophenyl)-5-methylimidazolidine-2,4-dione
CID 4804422

Frequently Asked Questions

What is the IUPAC name of (5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione?
The IUPAC name of (5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione (CID 51463779) is (5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione?
The canonical SMILES for (5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione is Cc1ccc([C@]2(C)NC(=O)N(Cc3ccccc3)C2=O)cc1.
What is the InChIKey of (5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione?
The InChIKey is SYNOQTRUURZHEA-SFHVURJKSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-13-8-10-15(11-9-13)18(2)16(21)20(17(22)19-18)12-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3,(H,19,22)/t18-/m0/s1.
What are the key properties of (5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione?
(5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione has a molecular weight of 294.35 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-3-benzyl-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 51463779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).