1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole

C17H22N2 — CID 86299944

IUPAC1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole
SMILESCc1cc(Cn2ccnc2)cc(C2CCCCC2)c1
InChIInChI=1S/C17H22N2/c1-14-9-15(12-19-8-7-18-13-19)11-17(10-14)16-5-3-2-4-6-16/h7-11,13,16H,2-6,12H2,1H3
InChIKeyQONHQXYKTRSFKT-UHFFFAOYSA-N
MW254.38 g/mol
LogP4.29
Rot. Bonds3

About 1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole

1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole (PubChem CID 86299944) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole.

Molecular Properties

Compound Name1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole
PubChem CID86299944
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole
SMILESCc1cc(Cn2ccnc2)cc(C2CCCCC2)c1
InChIInChI=1S/C17H22N2/c1-14-9-15(12-19-8-7-18-13-19)11-17(10-14)16-5-3-2-4-6-16/h7-11,13,16H,2-6,12H2,1H3
InChIKeyQONHQXYKTRSFKT-UHFFFAOYSA-N
XLogP4.29
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-3-[(3-cyclohexyl-5-methylphenyl)methyl]-5-methylbenzene
CID 19990202
ethane;1-[(3-methyl-5-propan-2-ylphenyl)methyl]imidazole
CID 143579531
1-[(4-methylphenyl)methyl]imidazole;molecular hydrogen
CID 167543192
1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone
CID 20561718
1-(4-cycloheptylphenyl)-2-imidazol-1-ylethanone
CID 54279792
1-(cyclooctylmethyl)imidazole
CID 20550238
3-(imidazol-1-ylmethyl)-N-[(3-methylphenyl)methyl]aniline
CID 43737809
N-[5-(imidazol-1-ylmethyl)-2-nitrophenyl]cycloheptanamine
CID 14518375
1-cyclohexyl-3-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-2-methylguanidine;hydroiodide
CID 110958222
5-(imidazol-1-ylmethyl)-2-[3-(2-methylphenyl)piperidin-1-yl]pyridine
CID 70755880
4-(imidazol-1-ylmethyl)-2-(1-methyl-2-oxoazocan-3-yl)benzonitrile
CID 11623957
4-(imidazol-1-ylmethyl)-1-[(3-methylphenyl)methyl]piperidine
CID 90493809

Frequently Asked Questions

What is the IUPAC name of 1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole?
The IUPAC name of 1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole (CID 86299944) is 1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole.
What is the SMILES notation for 1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole?
The canonical SMILES for 1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole is Cc1cc(Cn2ccnc2)cc(C2CCCCC2)c1.
What is the InChIKey of 1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole?
The InChIKey is QONHQXYKTRSFKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-14-9-15(12-19-8-7-18-13-19)11-17(10-14)16-5-3-2-4-6-16/h7-11,13,16H,2-6,12H2,1H3.
What are the key properties of 1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole?
1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole has a molecular weight of 254.38 g/mol, XLogP of 4.29, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole is sourced from PubChem (CID 86299944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).