5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione

C16H22N2O2 — CID 83169332

IUPAC5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione
SMILESCC(C)CCCN1C(=O)NC(=O)C1(C)c1ccccc1
InChIInChI=1S/C16H22N2O2/c1-12(2)8-7-11-18-15(20)17-14(19)16(18,3)13-9-5-4-6-10-13/h4-6,9-10,12H,7-8,11H2,1-3H3,(H,17,19,20)
InChIKeyRSCQCMRZHHNNAC-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.89
Rot. Bonds5

About 5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione

5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione (PubChem CID 83169332) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione
PubChem CID83169332
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione
SMILESCC(C)CCCN1C(=O)NC(=O)C1(C)c1ccccc1
InChIInChI=1S/C16H22N2O2/c1-12(2)8-7-11-18-15(20)17-14(19)16(18,3)13-9-5-4-6-10-13/h4-6,9-10,12H,7-8,11H2,1-3H3,(H,17,19,20)
InChIKeyRSCQCMRZHHNNAC-UHFFFAOYSA-N
XLogP2.89
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione (CID 83169332) is 5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione is CC(C)CCCN1C(=O)NC(=O)C1(C)c1ccccc1.
What is the InChIKey of 5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione?
The InChIKey is RSCQCMRZHHNNAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-12(2)8-7-11-18-15(20)17-14(19)16(18,3)13-9-5-4-6-10-13/h4-6,9-10,12H,7-8,11H2,1-3H3,(H,17,19,20).
What are the key properties of 5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione?
5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione has a molecular weight of 274.36 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(4-methylpentyl)-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 83169332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).