2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole

C14H18N2 — CID 22935263

IUPAC2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole
SMILESCc1cc(C)c(-c2nc(C)[nH]c2C)c(C)c1
InChIInChI=1S/C14H18N2/c1-8-6-9(2)13(10(3)7-8)14-11(4)15-12(5)16-14/h6-7H,1-5H3,(H,15,16)
InChIKeyAJGITBDEOCLATQ-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.62
Rot. Bonds1

About 2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole

2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole (PubChem CID 22935263) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole.

Molecular Properties

Compound Name2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole
PubChem CID22935263
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole
SMILESCc1cc(C)c(-c2nc(C)[nH]c2C)c(C)c1
InChIInChI=1S/C14H18N2/c1-8-6-9(2)13(10(3)7-8)14-11(4)15-12(5)16-14/h6-7H,1-5H3,(H,15,16)
InChIKeyAJGITBDEOCLATQ-UHFFFAOYSA-N
XLogP3.62
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole?
The IUPAC name of 2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole (CID 22935263) is 2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole.
What is the SMILES notation for 2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole?
The canonical SMILES for 2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole is Cc1cc(C)c(-c2nc(C)[nH]c2C)c(C)c1.
What is the InChIKey of 2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole?
The InChIKey is AJGITBDEOCLATQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-8-6-9(2)13(10(3)7-8)14-11(4)15-12(5)16-14/h6-7H,1-5H3,(H,15,16).
What are the key properties of 2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole?
2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole has a molecular weight of 214.31 g/mol, XLogP of 3.62, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-4-(2,4,6-trimethylphenyl)-1H-imidazole is sourced from PubChem (CID 22935263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).