[4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol

C14H17F3O2 — CID 63320664

IUPAC[4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol
SMILESOCc1ccc(OCC2CCCC2)c(C(F)(F)F)c1
InChIInChI=1S/C14H17F3O2/c15-14(16,17)12-7-11(8-18)5-6-13(12)19-9-10-3-1-2-4-10/h5-7,10,18H,1-4,8-9H2
InChIKeyGQERAMFYDPLDRI-UHFFFAOYSA-N
MW274.28 g/mol
LogP3.77
Rot. Bonds4

About [4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol

[4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol (PubChem CID 63320664) has the molecular formula C14H17F3O2 and a molecular weight of 274.28 g/mol. Its IUPAC name is [4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name[4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol
PubChem CID63320664
Molecular FormulaC14H17F3O2
Molecular Weight274.28 g/mol
Exact Mass274.12
IUPAC Name[4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol
SMILESOCc1ccc(OCC2CCCC2)c(C(F)(F)F)c1
InChIInChI=1S/C14H17F3O2/c15-14(16,17)12-7-11(8-18)5-6-13(12)19-9-10-3-1-2-4-10/h5-7,10,18H,1-4,8-9H2
InChIKeyGQERAMFYDPLDRI-UHFFFAOYSA-N
XLogP3.77
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(cyclobutylmethoxy)-3-(trifluoromethyl)phenol
CID 166611039
[3-chloro-4-(cyclobutylmethoxy)phenyl]methanol
CID 65459443
4-[[4-(chloromethyl)-2-(trifluoromethyl)phenoxy]methyl]oxane
CID 63320632
N-[[4-(cyclopropylmethoxy)-3-(trifluoromethyl)phenyl]methyl]propan-1-amine
CID 63320061
[4-(2,2,2-trifluoroethoxymethoxy)-3-(trifluoromethyl)phenyl]methanol
CID 106705149
[4-[2-(2,2,2-trifluoroethoxy)ethoxy]-3-(trifluoromethyl)phenyl]methanol
CID 63320753
[4-(2-cyclohexylethoxy)-3-fluorophenyl]methanol
CID 114191393
[3-fluoro-4-(oxan-4-ylmethoxy)phenyl]methanol
CID 107690757
4-[[4-(chloromethyl)-2-(trifluoromethyl)phenoxy]methyl]-1-methylsulfanylpiperidine
CID 168879276
[2-(cyclohexylmethoxy)-5-fluorophenyl]methanol
CID 107698568
[4-(3-methylbut-2-enoxy)-3-(trifluoromethyl)phenyl]methanol
CID 55204148
[4-(hydroxymethyl)-2-(trifluoromethyl)phenyl] dihydrogen phosphate
CID 139533131

Frequently Asked Questions

What is the IUPAC name of [4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol?
The IUPAC name of [4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol (CID 63320664) is [4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for [4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for [4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol is OCc1ccc(OCC2CCCC2)c(C(F)(F)F)c1.
What is the InChIKey of [4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol?
The InChIKey is GQERAMFYDPLDRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3O2/c15-14(16,17)12-7-11(8-18)5-6-13(12)19-9-10-3-1-2-4-10/h5-7,10,18H,1-4,8-9H2.
What are the key properties of [4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol?
[4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol has a molecular weight of 274.28 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(cyclopentylmethoxy)-3-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 63320664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).