1-methyl-2-(3-methylcyclohexyl)imidazole

C11H18N2 — CID 66875294

IUPAC1-methyl-2-(3-methylcyclohexyl)imidazole
SMILESCC1CCCC(c2nccn2C)C1
InChIInChI=1S/C11H18N2/c1-9-4-3-5-10(8-9)11-12-6-7-13(11)2/h6-7,9-10H,3-5,8H2,1-2H3
InChIKeySMUURKOVKDXRAE-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.71
Rot. Bonds1

About 1-methyl-2-(3-methylcyclohexyl)imidazole

1-methyl-2-(3-methylcyclohexyl)imidazole (PubChem CID 66875294) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 1-methyl-2-(3-methylcyclohexyl)imidazole.

Molecular Properties

Compound Name1-methyl-2-(3-methylcyclohexyl)imidazole
PubChem CID66875294
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name1-methyl-2-(3-methylcyclohexyl)imidazole
SMILESCC1CCCC(c2nccn2C)C1
InChIInChI=1S/C11H18N2/c1-9-4-3-5-10(8-9)11-12-6-7-13(11)2/h6-7,9-10H,3-5,8H2,1-2H3
InChIKeySMUURKOVKDXRAE-UHFFFAOYSA-N
XLogP2.71
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(3-methylcyclohexyl)imidazole?
The IUPAC name of 1-methyl-2-(3-methylcyclohexyl)imidazole (CID 66875294) is 1-methyl-2-(3-methylcyclohexyl)imidazole.
What is the SMILES notation for 1-methyl-2-(3-methylcyclohexyl)imidazole?
The canonical SMILES for 1-methyl-2-(3-methylcyclohexyl)imidazole is CC1CCCC(c2nccn2C)C1.
What is the InChIKey of 1-methyl-2-(3-methylcyclohexyl)imidazole?
The InChIKey is SMUURKOVKDXRAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-9-4-3-5-10(8-9)11-12-6-7-13(11)2/h6-7,9-10H,3-5,8H2,1-2H3.
What are the key properties of 1-methyl-2-(3-methylcyclohexyl)imidazole?
1-methyl-2-(3-methylcyclohexyl)imidazole has a molecular weight of 178.28 g/mol, XLogP of 2.71, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(3-methylcyclohexyl)imidazole is sourced from PubChem (CID 66875294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).