1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol

C14H18F2O2 — CID 104753752

IUPAC1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol
SMILESOC(COc1c(F)cccc1F)C1CCCCC1
InChIInChI=1S/C14H18F2O2/c15-11-7-4-8-12(16)14(11)18-9-13(17)10-5-2-1-3-6-10/h4,7-8,10,13,17H,1-3,5-6,9H2
InChIKeyKAZZGLLMWOUMHF-UHFFFAOYSA-N
MW256.29 g/mol
LogP3.28
Rot. Bonds4

About 1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol

1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol (PubChem CID 104753752) has the molecular formula C14H18F2O2 and a molecular weight of 256.29 g/mol. Its IUPAC name is 1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol.

Molecular Properties

Compound Name1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol
PubChem CID104753752
Molecular FormulaC14H18F2O2
Molecular Weight256.29 g/mol
Exact Mass256.13
IUPAC Name1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol
SMILESOC(COc1c(F)cccc1F)C1CCCCC1
InChIInChI=1S/C14H18F2O2/c15-11-7-4-8-12(16)14(11)18-9-13(17)10-5-2-1-3-6-10/h4,7-8,10,13,17H,1-3,5-6,9H2
InChIKeyKAZZGLLMWOUMHF-UHFFFAOYSA-N
XLogP3.28
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.29
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol
CID 104753717
1-cyclopentyl-2-naphthalen-1-yloxyethanol
CID 104753513
2-(4-chlorophenoxy)-1-cycloheptylethanol
CID 105122069
3-(2-cyclopentyl-2-hydroxyethoxy)phenol
CID 117245767
1-cyclopentyl-2-quinolin-5-yloxyethanol
CID 103045508
1-cyclopentyl-2-(2-methoxyphenoxy)ethanol
CID 113449278
N-[3-(2,6-difluorophenoxy)propyl]cyclohexanamine
CID 81269341
2-(2-chloro-3-fluorophenyl)-1-cyclopentylethanol
CID 112653044
3-[2-[(cyclopropylamino)methyl]-6-fluorophenoxy]propane-1,2-diol
CID 112609791
1-cyclobutyl-2-(3-methylphenoxy)ethanol
CID 117245576
N-[3-(2,6-difluorophenoxy)-2-methylpropyl]cyclopropanamine
CID 81269605
2-(2-fluorophenoxy)-1-(1-methylpiperidin-4-yl)ethanol
CID 117238738

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol?
The IUPAC name of 1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol (CID 104753752) is 1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol.
What is the SMILES notation for 1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol?
The canonical SMILES for 1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol is OC(COc1c(F)cccc1F)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol?
The InChIKey is KAZZGLLMWOUMHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2O2/c15-11-7-4-8-12(16)14(11)18-9-13(17)10-5-2-1-3-6-10/h4,7-8,10,13,17H,1-3,5-6,9H2.
What are the key properties of 1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol?
1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol has a molecular weight of 256.29 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol is sourced from PubChem (CID 104753752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).