4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one

C14H20N2O — CID 116855787

IUPAC4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one
SMILESCc1ccc(C(C)(C)C)cc1C1CNC(=O)N1
InChIInChI=1S/C14H20N2O/c1-9-5-6-10(14(2,3)4)7-11(9)12-8-15-13(17)16-12/h5-7,12H,8H2,1-4H3,(H2,15,16,17)
InChIKeyUWGSJSMKXJWWMM-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.65
Rot. Bonds1

About 4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one

4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one (PubChem CID 116855787) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one
PubChem CID116855787
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one
SMILESCc1ccc(C(C)(C)C)cc1C1CNC(=O)N1
InChIInChI=1S/C14H20N2O/c1-9-5-6-10(14(2,3)4)7-11(9)12-8-15-13(17)16-12/h5-7,12H,8H2,1-4H3,(H2,15,16,17)
InChIKeyUWGSJSMKXJWWMM-UHFFFAOYSA-N
XLogP2.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one?
The IUPAC name of 4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one (CID 116855787) is 4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one.
What is the SMILES notation for 4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one?
The canonical SMILES for 4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one is Cc1ccc(C(C)(C)C)cc1C1CNC(=O)N1.
What is the InChIKey of 4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one?
The InChIKey is UWGSJSMKXJWWMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-9-5-6-10(14(2,3)4)7-11(9)12-8-15-13(17)16-12/h5-7,12H,8H2,1-4H3,(H2,15,16,17).
What are the key properties of 4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one?
4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one has a molecular weight of 232.33 g/mol, XLogP of 2.65, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-tert-butyl-2-methylphenyl)imidazolidin-2-one is sourced from PubChem (CID 116855787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).