cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol

C14H17F3O2 — CID 62790469

IUPACcyclohexyl-[2-(trifluoromethoxy)phenyl]methanol
SMILESOC(c1ccccc1OC(F)(F)F)C1CCCCC1
InChIInChI=1S/C14H17F3O2/c15-14(16,17)19-12-9-5-4-8-11(12)13(18)10-6-2-1-3-7-10/h4-5,8-10,13,18H,1-3,6-7H2
InChIKeyPPKFAJNQJUUQNE-UHFFFAOYSA-N
MW274.28 g/mol
LogP4.20
Rot. Bonds3

About cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol

cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol (PubChem CID 62790469) has the molecular formula C14H17F3O2 and a molecular weight of 274.28 g/mol. Its IUPAC name is cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol.

Molecular Properties

Compound Namecyclohexyl-[2-(trifluoromethoxy)phenyl]methanol
PubChem CID62790469
Molecular FormulaC14H17F3O2
Molecular Weight274.28 g/mol
Exact Mass274.12
IUPAC Namecyclohexyl-[2-(trifluoromethoxy)phenyl]methanol
SMILESOC(c1ccccc1OC(F)(F)F)C1CCCCC1
InChIInChI=1S/C14H17F3O2/c15-14(16,17)19-12-9-5-4-8-11(12)13(18)10-6-2-1-3-7-10/h4-5,8-10,13,18H,1-3,6-7H2
InChIKeyPPKFAJNQJUUQNE-UHFFFAOYSA-N
XLogP4.20
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S,2R)-2-amino-1-cyclopentyl-2-[2-(trifluoromethoxy)phenyl]ethanol;hydrochloride
CID 171160319
cyclooctyl-(2-propan-2-yloxyphenyl)methanol
CID 80603247
cyclohexyl-[2-(trifluoromethyl)phenyl]methanol
CID 62801472
(2-ethylcyclohexyl)-[2-(trifluoromethoxy)phenyl]methanol
CID 63894152
(2-methylcyclopropyl)-[2-(trifluoromethoxy)phenyl]methanol
CID 65420822
2-cyclohexyl-1-[2-(trifluoromethoxy)phenyl]ethanamine
CID 115850794
cyclooctyl-(2-fluoro-3-methoxyphenyl)methanol
CID 82808519
2-(cyclopentylamino)-2-[2-(trifluoromethoxy)phenyl]acetic acid
CID 60997656
1-[(S)-cyclohexyl-[2-(trifluoromethoxy)phenyl]methyl]piperazine;hydrochloride
CID 171166606
2-(cyclopentylamino)-2-[2-(trifluoromethoxy)phenyl]acetamide
CID 61001989
N-cyclohexyl-1-[2-(trifluoromethoxy)phenyl]ethane-1,2-diamine
CID 65384955
(1S,2R)-2-amino-2-[5-bromo-2-(trifluoromethoxy)phenyl]-1-cyclopentylethanol
CID 171263460

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol?
The IUPAC name of cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol (CID 62790469) is cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol.
What is the SMILES notation for cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol?
The canonical SMILES for cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol is OC(c1ccccc1OC(F)(F)F)C1CCCCC1.
What is the InChIKey of cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol?
The InChIKey is PPKFAJNQJUUQNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3O2/c15-14(16,17)19-12-9-5-4-8-11(12)13(18)10-6-2-1-3-7-10/h4-5,8-10,13,18H,1-3,6-7H2.
What are the key properties of cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol?
cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol has a molecular weight of 274.28 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[2-(trifluoromethoxy)phenyl]methanol is sourced from PubChem (CID 62790469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).