[3-(trifluoromethyl)cyclohexyl]methanol

C8H13F3O — CID 57482808

IUPAC[3-(trifluoromethyl)cyclohexyl]methanol
SMILESOCC1CCCC(C(F)(F)F)C1
InChIInChI=1S/C8H13F3O/c9-8(10,11)7-3-1-2-6(4-7)5-12/h6-7,12H,1-5H2
InChIKeyADWFXAOWIYRGPS-UHFFFAOYSA-N
MW182.18 g/mol
LogP2.35
Rot. Bonds1

About [3-(trifluoromethyl)cyclohexyl]methanol

[3-(trifluoromethyl)cyclohexyl]methanol (PubChem CID 57482808) has the molecular formula C8H13F3O and a molecular weight of 182.18 g/mol. Its IUPAC name is [3-(trifluoromethyl)cyclohexyl]methanol.

Molecular Properties

Compound Name[3-(trifluoromethyl)cyclohexyl]methanol
PubChem CID57482808
Molecular FormulaC8H13F3O
Molecular Weight182.18 g/mol
Exact Mass182.09
IUPAC Name[3-(trifluoromethyl)cyclohexyl]methanol
SMILESOCC1CCCC(C(F)(F)F)C1
InChIInChI=1S/C8H13F3O/c9-8(10,11)7-3-1-2-6(4-7)5-12/h6-7,12H,1-5H2
InChIKeyADWFXAOWIYRGPS-UHFFFAOYSA-N
XLogP2.35
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [3-(trifluoromethyl)cyclohexyl]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

2-(Trifluoromethyl)cyclohexanol
CID 2777485
1-Cyclohexyl-2,2,2-trifluoroethan-1-ol
CID 10943092
(3-Methylcyclohexyl)methanol
CID 15004795
(4,4-Difluorocyclohexyl)methanol
CID 21184133
Cyclohexanemethanol, 3,5-dimethyl-
CID 109419
(4-Fluorocyclohexyl)methanol
CID 44228134
(3-Fluorocyclohexyl)methanol
CID 44228136
[4-(Trifluoromethyl)cyclohexyl]methanol
CID 44228198
2-Cyclohexyl-2-fluoroethan-1-ol
CID 58695120
2-(4,4-Difluorocyclohexyl)ethan-1-ol
CID 66583726
((trans)-2-(Trifluoromethyl)cyclohexyl)methanol
CID 67981540
(1-(Trifluoromethyl)cyclohexyl)methanol
CID 86703447

Frequently Asked Questions

What is the IUPAC name of [3-(trifluoromethyl)cyclohexyl]methanol?
The IUPAC name of [3-(trifluoromethyl)cyclohexyl]methanol (CID 57482808) is [3-(trifluoromethyl)cyclohexyl]methanol.
What is the SMILES notation for [3-(trifluoromethyl)cyclohexyl]methanol?
The canonical SMILES for [3-(trifluoromethyl)cyclohexyl]methanol is OCC1CCCC(C(F)(F)F)C1.
What is the InChIKey of [3-(trifluoromethyl)cyclohexyl]methanol?
The InChIKey is ADWFXAOWIYRGPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F3O/c9-8(10,11)7-3-1-2-6(4-7)5-12/h6-7,12H,1-5H2.
What are the key properties of [3-(trifluoromethyl)cyclohexyl]methanol?
[3-(trifluoromethyl)cyclohexyl]methanol has a molecular weight of 182.18 g/mol, XLogP of 2.35, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(trifluoromethyl)cyclohexyl]methanol is sourced from PubChem (CID 57482808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).