1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol

C14H17F3O — CID 62607269

IUPAC1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol
SMILESOC(Cc1ccc(C(F)(F)F)cc1)C1CCCC1
InChIInChI=1S/C14H17F3O/c15-14(16,17)12-7-5-10(6-8-12)9-13(18)11-3-1-2-4-11/h5-8,11,13,18H,1-4,9H2
InChIKeyZDMSSOLPZDOIRX-UHFFFAOYSA-N
MW258.28 g/mol
LogP3.80
Rot. Bonds3

About 1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol

1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol (PubChem CID 62607269) has the molecular formula C14H17F3O and a molecular weight of 258.28 g/mol. Its IUPAC name is 1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol.

Molecular Properties

Compound Name1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol
PubChem CID62607269
Molecular FormulaC14H17F3O
Molecular Weight258.28 g/mol
Exact Mass258.12
IUPAC Name1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol
SMILESOC(Cc1ccc(C(F)(F)F)cc1)C1CCCC1
InChIInChI=1S/C14H17F3O/c15-14(16,17)12-7-5-10(6-8-12)9-13(18)11-3-1-2-4-11/h5-8,11,13,18H,1-4,9H2
InChIKeyZDMSSOLPZDOIRX-UHFFFAOYSA-N
XLogP3.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclohexyl-3-[4-(trifluoromethyl)phenyl]propan-2-ol
CID 63520008
1-(2-methylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol
CID 107183450
1-(3-ethylcyclopentyl)-2-[4-(trifluoromethyl)phenyl]ethanol
CID 65410943
2-(4-tert-butylphenyl)-1-cyclopropylethanol
CID 62608769
(1R)-1-cyclopentyl-2-phenylethanol
CID 39238299
1-cyclohexyl-2-pyridin-4-ylethanol
CID 62552593
(1R)-1-cyclopentyl-2-(4-phenylphenyl)ethanol
CID 167627883
1-cyclobutyl-2-(4-ethylphenyl)ethanol
CID 64986891
(1R)-1-cyclopentyl-2-(4-isocyanophenyl)ethanol
CID 167600093
1-cyclohexyl-2-(4-propan-2-ylphenyl)ethanol
CID 63410841
cyclooctyl-[4-(trifluoromethyl)phenyl]methanol
CID 80603410
1-(2-chloro-3-cyclopropylbutyl)-4-(trifluoromethyl)benzene
CID 83149862

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol?
The IUPAC name of 1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol (CID 62607269) is 1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol.
What is the SMILES notation for 1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol?
The canonical SMILES for 1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol is OC(Cc1ccc(C(F)(F)F)cc1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol?
The InChIKey is ZDMSSOLPZDOIRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3O/c15-14(16,17)12-7-5-10(6-8-12)9-13(18)11-3-1-2-4-11/h5-8,11,13,18H,1-4,9H2.
What are the key properties of 1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol?
1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol has a molecular weight of 258.28 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-[4-(trifluoromethyl)phenyl]ethanol is sourced from PubChem (CID 62607269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).