1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole

C17H22N2O2 — CID 155924197

IUPAC1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole
SMILESCOc1ccc(-c2cncn2C2CCCCC2)c(OC)c1
InChIInChI=1S/C17H22N2O2/c1-20-14-8-9-15(17(10-14)21-2)16-11-18-12-19(16)13-6-4-3-5-7-13/h8-13H,3-7H2,1-2H3
InChIKeyLKFYOSOBDJYKLZ-UHFFFAOYSA-N
MW286.38 g/mol
LogP4.07
Rot. Bonds4

About 1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole

1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole (PubChem CID 155924197) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole.

Molecular Properties

Compound Name1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole
PubChem CID155924197
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole
SMILESCOc1ccc(-c2cncn2C2CCCCC2)c(OC)c1
InChIInChI=1S/C17H22N2O2/c1-20-14-8-9-15(17(10-14)21-2)16-11-18-12-19(16)13-6-4-3-5-7-13/h8-13H,3-7H2,1-2H3
InChIKeyLKFYOSOBDJYKLZ-UHFFFAOYSA-N
XLogP4.07
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole?
The IUPAC name of 1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole (CID 155924197) is 1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole.
What is the SMILES notation for 1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole?
The canonical SMILES for 1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole is COc1ccc(-c2cncn2C2CCCCC2)c(OC)c1.
What is the InChIKey of 1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole?
The InChIKey is LKFYOSOBDJYKLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-20-14-8-9-15(17(10-14)21-2)16-11-18-12-19(16)13-6-4-3-5-7-13/h8-13H,3-7H2,1-2H3.
What are the key properties of 1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole?
1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole has a molecular weight of 286.38 g/mol, XLogP of 4.07, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-5-(2,4-dimethoxyphenyl)imidazole is sourced from PubChem (CID 155924197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).