1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol

C17H22N2O — CID 134836362

IUPAC1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol
SMILESCC(O)(c1ccccc1)c1nccn1C1CCCCC1
InChIInChI=1S/C17H22N2O/c1-17(20,14-8-4-2-5-9-14)16-18-12-13-19(16)15-10-6-3-7-11-15/h2,4-5,8-9,12-13,15,20H,3,6-7,10-11H2,1H3
InChIKeyWYIJIAVBZDNFIL-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.64
Rot. Bonds3

About 1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol

1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol (PubChem CID 134836362) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol.

Molecular Properties

Compound Name1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol
PubChem CID134836362
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol
SMILESCC(O)(c1ccccc1)c1nccn1C1CCCCC1
InChIInChI=1S/C17H22N2O/c1-17(20,14-8-4-2-5-9-14)16-18-12-13-19(16)15-10-6-3-7-11-15/h2,4-5,8-9,12-13,15,20H,3,6-7,10-11H2,1H3
InChIKeyWYIJIAVBZDNFIL-UHFFFAOYSA-N
XLogP3.64
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol?
The IUPAC name of 1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol (CID 134836362) is 1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol.
What is the SMILES notation for 1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol?
The canonical SMILES for 1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol is CC(O)(c1ccccc1)c1nccn1C1CCCCC1.
What is the InChIKey of 1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol?
The InChIKey is WYIJIAVBZDNFIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-17(20,14-8-4-2-5-9-14)16-18-12-13-19(16)15-10-6-3-7-11-15/h2,4-5,8-9,12-13,15,20H,3,6-7,10-11H2,1H3.
What are the key properties of 1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol?
1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol has a molecular weight of 270.38 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexylimidazol-2-yl)-1-phenylethanol is sourced from PubChem (CID 134836362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).