1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol

C15H21FO2 — CID 104753717

IUPAC1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol
SMILESOC(COCc1ccccc1F)C1CCCCC1
InChIInChI=1S/C15H21FO2/c16-14-9-5-4-8-13(14)10-18-11-15(17)12-6-2-1-3-7-12/h4-5,8-9,12,15,17H,1-3,6-7,10-11H2
InChIKeyVVNBZLPELFHLTH-UHFFFAOYSA-N
MW252.33 g/mol
LogP3.28
Rot. Bonds5

About 1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol

1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol (PubChem CID 104753717) has the molecular formula C15H21FO2 and a molecular weight of 252.33 g/mol. Its IUPAC name is 1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol.

Molecular Properties

Compound Name1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol
PubChem CID104753717
Molecular FormulaC15H21FO2
Molecular Weight252.33 g/mol
Exact Mass252.15
IUPAC Name1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol
SMILESOC(COCc1ccccc1F)C1CCCCC1
InChIInChI=1S/C15H21FO2/c16-14-9-5-4-8-13(14)10-18-11-15(17)12-6-2-1-3-7-12/h4-5,8-9,12,15,17H,1-3,6-7,10-11H2
InChIKeyVVNBZLPELFHLTH-UHFFFAOYSA-N
XLogP3.28
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.33
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-N-ethyl-2-[(2-fluorophenyl)methoxy]ethanamine
CID 104749468
1-(cyclopropylamino)-3-[(2-fluorophenyl)methoxy]propan-2-ol
CID 3604770
1-cyclohexyl-2-(2,6-difluorophenoxy)ethanol
CID 104753752
(2R)-1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-3-[(2-fluorophenyl)methoxy]propan-2-ol
CID 25346087
2-[(2-fluorophenyl)methoxy]-1-phenylethanol
CID 63937773
1-[(2-fluorophenyl)methoxy]-3-[2-(hydroxymethyl)piperidin-1-yl]propan-2-ol
CID 110877558
(2S)-1-[(2-fluorophenyl)methoxy]-3-pyrrolidin-1-ylpropan-2-ol
CID 2314434
1-fluoro-2-[(2-fluorophenyl)methoxymethyl]benzene
CID 67509440
1-(2-ethylpiperidin-1-yl)-3-[(2-fluorophenyl)methoxy]propan-2-ol
CID 17390802
(2S)-1-[(2-fluorophenyl)methoxy]-3-[(3S)-3-phenylpyrrolidin-1-yl]propan-2-ol
CID 95336881
2-(2-chloro-3-fluorophenyl)-1-cyclopentylethanol
CID 112653044
N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-3-(2-fluorophenyl)propanamide
CID 95292204

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol?
The IUPAC name of 1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol (CID 104753717) is 1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol.
What is the SMILES notation for 1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol?
The canonical SMILES for 1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol is OC(COCc1ccccc1F)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol?
The InChIKey is VVNBZLPELFHLTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FO2/c16-14-9-5-4-8-13(14)10-18-11-15(17)12-6-2-1-3-7-12/h4-5,8-9,12,15,17H,1-3,6-7,10-11H2.
What are the key properties of 1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol?
1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol has a molecular weight of 252.33 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-[(2-fluorophenyl)methoxy]ethanol is sourced from PubChem (CID 104753717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).