(5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione

C18H18N2O2 — CID 156703225

IUPAC(5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione
SMILESCc1ccc(N2C(=O)[C@H](C)N(Cc3ccccc3)C2=O)cc1
InChIInChI=1S/C18H18N2O2/c1-13-8-10-16(11-9-13)20-17(21)14(2)19(18(20)22)12-15-6-4-3-5-7-15/h3-11,14H,12H2,1-2H3/t14-/m0/s1
InChIKeyDIHOAIZTOQASGA-AWEZNQCLSA-N
MW294.35 g/mol
LogP3.35
Rot. Bonds3

About (5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione

(5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione (PubChem CID 156703225) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is (5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione
PubChem CID156703225
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name(5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione
SMILESCc1ccc(N2C(=O)[C@H](C)N(Cc3ccccc3)C2=O)cc1
InChIInChI=1S/C18H18N2O2/c1-13-8-10-16(11-9-13)20-17(21)14(2)19(18(20)22)12-15-6-4-3-5-7-15/h3-11,14H,12H2,1-2H3/t14-/m0/s1
InChIKeyDIHOAIZTOQASGA-AWEZNQCLSA-N
XLogP3.35
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(5S)-1-benzyl-3-(4-chlorophenyl)-5-methylimidazolidine-2,4-dione
CID 97046899
(5S)-1-benzyl-3-(4-hydroxyphenyl)-5-methylimidazolidine-2,4-dione
CID 156703188
methyl 4-[(4S)-3-benzyl-4-methyl-2,5-dioxoimidazolidin-1-yl]benzoate
CID 156703245
6-bromo-1-[(4-methylphenyl)methyl]-3-phenyl-4a,5,6,7,8,8a-hexahydroquinazoline-2,4-dione
CID 73371635
4-[[(5S)-3-(4-chlorophenyl)-5-methyl-2,4-dioxoimidazolidin-1-yl]methyl]benzonitrile
CID 156703195
5-benzyl-1-[(4-methylphenyl)methyl]-3-phenyl-1,3-diazinane-2,4,6-trione
CID 144582870
1-benzyl-3-(4-chlorophenyl)-5-methylimidazolidine-2,4-dione;ethyl (2R)-1-(4-methylphenyl)sulfonyl-4-(4-methylphenyl)sulfonyloxypyrrolidine-2-carboxylate
CID 131716959
(5R)-1-benzyl-5-(4-methylphenyl)-3-phenyl-2-sulfanylideneimidazolidin-4-one
CID 35674628
1-benzyl-3-(4-methylphenyl)imidazolidine-2,4-dione
CID 164659301
1-benzyl-3-hydroxy-4-(4-methylphenyl)azetidin-2-one
CID 91824522
(5S)-3-(4-chlorophenyl)-5-methyl-1-phenylimidazolidine-2,4-dione
CID 154708544
(4aR,7aS)-1-benzyl-3-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[d]pyrimidine-2,4-dione
CID 10853143

Frequently Asked Questions

What is the IUPAC name of (5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione?
The IUPAC name of (5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione (CID 156703225) is (5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione?
The canonical SMILES for (5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione is Cc1ccc(N2C(=O)[C@H](C)N(Cc3ccccc3)C2=O)cc1.
What is the InChIKey of (5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione?
The InChIKey is DIHOAIZTOQASGA-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-13-8-10-16(11-9-13)20-17(21)14(2)19(18(20)22)12-15-6-4-3-5-7-15/h3-11,14H,12H2,1-2H3/t14-/m0/s1.
What are the key properties of (5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione?
(5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione has a molecular weight of 294.35 g/mol, XLogP of 3.35, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-1-benzyl-5-methyl-3-(4-methylphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 156703225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).