cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol

C13H14F4O — CID 115351164

IUPACcyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol
SMILESOC(c1cc(F)cc(C(F)(F)F)c1)C1CCCC1
InChIInChI=1S/C13H14F4O/c14-11-6-9(5-10(7-11)13(15,16)17)12(18)8-3-1-2-4-8/h5-8,12,18H,1-4H2
InChIKeyQHDJXRGTKMDUCA-UHFFFAOYSA-N
MW262.25 g/mol
LogP4.07
Rot. Bonds2

About cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol

cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol (PubChem CID 115351164) has the molecular formula C13H14F4O and a molecular weight of 262.25 g/mol. Its IUPAC name is cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Namecyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol
PubChem CID115351164
Molecular FormulaC13H14F4O
Molecular Weight262.25 g/mol
Exact Mass262.10
IUPAC Namecyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol
SMILESOC(c1cc(F)cc(C(F)(F)F)c1)C1CCCC1
InChIInChI=1S/C13H14F4O/c14-11-6-9(5-10(7-11)13(15,16)17)12(18)8-3-1-2-4-8/h5-8,12,18H,1-4H2
InChIKeyQHDJXRGTKMDUCA-UHFFFAOYSA-N
XLogP4.07
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.25
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cyclopropyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 115351077
[3-fluoro-5-(trifluoromethyl)phenyl]-(oxan-3-yl)methanol
CID 107135674
2-cyclopentyl-1-[3-fluoro-5-(trifluoromethyl)phenyl]ethanol
CID 115351165
(1R,2S)-2-amino-1-cyclohexyl-2-[3-fluoro-5-(trifluoromethyl)phenyl]ethanol;hydrochloride
CID 171268935
(3,4-dimethylcyclohexyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 115351175
(S)-cyclopropyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanamine
CID 131485190
cycloheptyl-(3-fluoro-5-methylphenyl)methanol
CID 79703242
cyclopropyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanamine;hydrochloride
CID 138986249
(3-bromo-5-fluorophenyl)-cyclohexylmethanol
CID 66425421
cyclooctyl-[4-(trifluoromethyl)phenyl]methanol
CID 80603410
cyclobutyl-[3-(trifluoromethyl)phenyl]methanol
CID 64986539
(1R)-1-[3-fluoro-5-(trifluoromethyl)phenyl]ethane-1,2-diol
CID 175586599

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol?
The IUPAC name of cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol (CID 115351164) is cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol is OC(c1cc(F)cc(C(F)(F)F)c1)C1CCCC1.
What is the InChIKey of cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol?
The InChIKey is QHDJXRGTKMDUCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14F4O/c14-11-6-9(5-10(7-11)13(15,16)17)12(18)8-3-1-2-4-8/h5-8,12,18H,1-4H2.
What are the key properties of cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol?
cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol has a molecular weight of 262.25 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[3-fluoro-5-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 115351164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).