2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole

C18H24N2O — CID 141388636

IUPAC2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole
SMILESCOC1CCC(c2nc(-c3ccccc3C)c(C)[nH]2)CC1
InChIInChI=1S/C18H24N2O/c1-12-6-4-5-7-16(12)17-13(2)19-18(20-17)14-8-10-15(21-3)11-9-14/h4-7,14-15H,8-11H2,1-3H3,(H,19,20)
InChIKeyPBLHAYDGVUKHPR-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.37
Rot. Bonds3

About 2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole

2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole (PubChem CID 141388636) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole.

Molecular Properties

Compound Name2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole
PubChem CID141388636
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole
SMILESCOC1CCC(c2nc(-c3ccccc3C)c(C)[nH]2)CC1
InChIInChI=1S/C18H24N2O/c1-12-6-4-5-7-16(12)17-13(2)19-18(20-17)14-8-10-15(21-3)11-9-14/h4-7,14-15H,8-11H2,1-3H3,(H,19,20)
InChIKeyPBLHAYDGVUKHPR-UHFFFAOYSA-N
XLogP4.37
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole?
The IUPAC name of 2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole (CID 141388636) is 2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole.
What is the SMILES notation for 2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole?
The canonical SMILES for 2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole is COC1CCC(c2nc(-c3ccccc3C)c(C)[nH]2)CC1.
What is the InChIKey of 2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole?
The InChIKey is PBLHAYDGVUKHPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-12-6-4-5-7-16(12)17-13(2)19-18(20-17)14-8-10-15(21-3)11-9-14/h4-7,14-15H,8-11H2,1-3H3,(H,19,20).
What are the key properties of 2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole?
2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole has a molecular weight of 284.40 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxycyclohexyl)-5-methyl-4-(2-methylphenyl)-1H-imidazole is sourced from PubChem (CID 141388636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).