3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione

C14H18N2O2 — CID 63064185

IUPAC3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione
SMILESCc1ccc(N2C(=O)CN(CC(C)C)C2=O)cc1
InChIInChI=1S/C14H18N2O2/c1-10(2)8-15-9-13(17)16(14(15)18)12-6-4-11(3)5-7-12/h4-7,10H,8-9H2,1-3H3
InChIKeyHOHDOTLCDIVVKN-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.42
Rot. Bonds3

About 3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione

3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione (PubChem CID 63064185) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione
PubChem CID63064185
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione
SMILESCc1ccc(N2C(=O)CN(CC(C)C)C2=O)cc1
InChIInChI=1S/C14H18N2O2/c1-10(2)8-15-9-13(17)16(14(15)18)12-6-4-11(3)5-7-12/h4-7,10H,8-9H2,1-3H3
InChIKeyHOHDOTLCDIVVKN-UHFFFAOYSA-N
XLogP2.42
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.42
H-Bond Donors ≤ 50
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 3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione?
The IUPAC name of 3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione (CID 63064185) is 3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione is Cc1ccc(N2C(=O)CN(CC(C)C)C2=O)cc1.
What is the InChIKey of 3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione?
The InChIKey is HOHDOTLCDIVVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-10(2)8-15-9-13(17)16(14(15)18)12-6-4-11(3)5-7-12/h4-7,10H,8-9H2,1-3H3.
What are the key properties of 3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione?
3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione has a molecular weight of 246.31 g/mol, XLogP of 2.42, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylphenyl)-1-(2-methylpropyl)imidazolidine-2,4-dione is sourced from PubChem (CID 63064185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).