2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene

C20H24N2 — CID 175460608

IUPAC2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene
SMILESCc1cc(C)c(-c2ncc[nH]2)c(C)c1.Cc1ccccc1C
InChIInChI=1S/C12H14N2.C8H10/c1-8-6-9(2)11(10(3)7-8)12-13-4-5-14-12;1-7-5-3-4-6-8(7)2/h4-7H,1-3H3,(H,13,14);3-6H,1-2H3
InChIKeyABGZBHAQUDOZSX-UHFFFAOYSA-N
MW292.43 g/mol
LogP5.31
Rot. Bonds1

About 2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene

2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene (PubChem CID 175460608) has the molecular formula C20H24N2 and a molecular weight of 292.43 g/mol. Its IUPAC name is 2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene.

Molecular Properties

Compound Name2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene
PubChem CID175460608
Molecular FormulaC20H24N2
Molecular Weight292.43 g/mol
Exact Mass292.19
IUPAC Name2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene
SMILESCc1cc(C)c(-c2ncc[nH]2)c(C)c1.Cc1ccccc1C
InChIInChI=1S/C12H14N2.C8H10/c1-8-6-9(2)11(10(3)7-8)12-13-4-5-14-12;1-7-5-3-4-6-8(7)2/h4-7H,1-3H3,(H,13,14);3-6H,1-2H3
InChIKeyABGZBHAQUDOZSX-UHFFFAOYSA-N
XLogP5.31
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.43
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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ethane;2-naphthalen-2-yl-1H-imidazole
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2-(2-bromo-4-methyl-6-propylphenyl)-1H-imidazole
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Frequently Asked Questions

What is the IUPAC name of 2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene?
The IUPAC name of 2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene (CID 175460608) is 2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene.
What is the SMILES notation for 2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene?
The canonical SMILES for 2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene is Cc1cc(C)c(-c2ncc[nH]2)c(C)c1.Cc1ccccc1C.
What is the InChIKey of 2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene?
The InChIKey is ABGZBHAQUDOZSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2.C8H10/c1-8-6-9(2)11(10(3)7-8)12-13-4-5-14-12;1-7-5-3-4-6-8(7)2/h4-7H,1-3H3,(H,13,14);3-6H,1-2H3.
What are the key properties of 2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene?
2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene has a molecular weight of 292.43 g/mol, XLogP of 5.31, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4,6-trimethylphenyl)-1H-imidazole;1,2-xylene is sourced from PubChem (CID 175460608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).