1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one

C13H18N2O — CID 116855973

IUPAC1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one
SMILESCc1ccc(C2CNC(=O)N2C)c(C)c1C
InChIInChI=1S/C13H18N2O/c1-8-5-6-11(10(3)9(8)2)12-7-14-13(16)15(12)4/h5-6,12H,7H2,1-4H3,(H,14,16)
InChIKeyZNGZCULWMUPISM-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.31
Rot. Bonds1

About 1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one

1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one (PubChem CID 116855973) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one
PubChem CID116855973
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one
SMILESCc1ccc(C2CNC(=O)N2C)c(C)c1C
InChIInChI=1S/C13H18N2O/c1-8-5-6-11(10(3)9(8)2)12-7-14-13(16)15(12)4/h5-6,12H,7H2,1-4H3,(H,14,16)
InChIKeyZNGZCULWMUPISM-UHFFFAOYSA-N
XLogP2.31
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one?
The IUPAC name of 1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one (CID 116855973) is 1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one.
What is the SMILES notation for 1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one?
The canonical SMILES for 1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one is Cc1ccc(C2CNC(=O)N2C)c(C)c1C.
What is the InChIKey of 1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one?
The InChIKey is ZNGZCULWMUPISM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-8-5-6-11(10(3)9(8)2)12-7-14-13(16)15(12)4/h5-6,12H,7H2,1-4H3,(H,14,16).
What are the key properties of 1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one?
1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one has a molecular weight of 218.30 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(2,3,4-trimethylphenyl)imidazolidin-2-one is sourced from PubChem (CID 116855973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).