5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione

C19H24N2O3 — CID 90358274

IUPAC5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione
SMILESCC1CCCC(C2(C)NC(=O)N(CC(=O)c3ccccc3)C2=O)C1
InChIInChI=1S/C19H24N2O3/c1-13-7-6-10-15(11-13)19(2)17(23)21(18(24)20-19)12-16(22)14-8-4-3-5-9-14/h3-5,8-9,13,15H,6-7,10-12H2,1-2H3,(H,20,24)
InChIKeyLQPDLTJOXHIMJK-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.01
Rot. Bonds4

About 5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione

5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione (PubChem CID 90358274) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione
PubChem CID90358274
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione
SMILESCC1CCCC(C2(C)NC(=O)N(CC(=O)c3ccccc3)C2=O)C1
InChIInChI=1S/C19H24N2O3/c1-13-7-6-10-15(11-13)19(2)17(23)21(18(24)20-19)12-16(22)14-8-4-3-5-9-14/h3-5,8-9,13,15H,6-7,10-12H2,1-2H3,(H,20,24)
InChIKeyLQPDLTJOXHIMJK-UHFFFAOYSA-N
XLogP3.01
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione?
The IUPAC name of 5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione (CID 90358274) is 5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione.
What is the SMILES notation for 5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione?
The canonical SMILES for 5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione is CC1CCCC(C2(C)NC(=O)N(CC(=O)c3ccccc3)C2=O)C1.
What is the InChIKey of 5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione?
The InChIKey is LQPDLTJOXHIMJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-13-7-6-10-15(11-13)19(2)17(23)21(18(24)20-19)12-16(22)14-8-4-3-5-9-14/h3-5,8-9,13,15H,6-7,10-12H2,1-2H3,(H,20,24).
What are the key properties of 5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione?
5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione has a molecular weight of 328.41 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione is sourced from PubChem (CID 90358274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).