1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol

C14H18F3NO — CID 3895296

IUPAC1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol
SMILESOC(CN1CCCC(C(F)(F)F)C1)c1ccccc1
InChIInChI=1S/C14H18F3NO/c15-14(16,17)12-7-4-8-18(9-12)10-13(19)11-5-2-1-3-6-11/h1-3,5-6,12-13,19H,4,7-10H2
InChIKeyHMDFHKCUQNUSEN-UHFFFAOYSA-N
MW273.30 g/mol
LogP2.99
Rot. Bonds3

About 1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol

1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol (PubChem CID 3895296) has the molecular formula C14H18F3NO and a molecular weight of 273.30 g/mol. Its IUPAC name is 1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol.

Molecular Properties

Compound Name1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol
PubChem CID3895296
Molecular FormulaC14H18F3NO
Molecular Weight273.30 g/mol
Exact Mass273.13
IUPAC Name1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol
SMILESOC(CN1CCCC(C(F)(F)F)C1)c1ccccc1
InChIInChI=1S/C14H18F3NO/c15-14(16,17)12-7-4-8-18(9-12)10-13(19)11-5-2-1-3-6-11/h1-3,5-6,12-13,19H,4,7-10H2
InChIKeyHMDFHKCUQNUSEN-UHFFFAOYSA-N
XLogP2.99
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol 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

Glemanserin
CID 71781
N-Methylephedrine
CID 4374
Methylephedrine
CID 64782
Cinnamedrine
CID 5370611
Benzenemethanol, alpha-(1-(dimethylamino)ethyl)-, hydrochloride, (R*,S*)-(+-)-
CID 198190
3-(Dimethylamino)-1-phenylpropan-1-ol
CID 110665
(1S,2S)-(+)-N-Methylpseudoephedrine
CID 7059596
Etafedrine
CID 94532
[1-[2-(4-Fluorophenyl)ethyl]piperidin-4-yl]-phenylmethanol
CID 44363475
4-Morpholineethanol, alpha-phenyl-
CID 20491
Benzyl alcohol, alpha-(phenethylamino)methyl-
CID 20118
alpha-((Cyclohexylamino)methyl)benzenemethanol
CID 23064

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol?
The IUPAC name of 1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol (CID 3895296) is 1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol.
What is the SMILES notation for 1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol?
The canonical SMILES for 1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol is OC(CN1CCCC(C(F)(F)F)C1)c1ccccc1.
What is the InChIKey of 1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol?
The InChIKey is HMDFHKCUQNUSEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F3NO/c15-14(16,17)12-7-4-8-18(9-12)10-13(19)11-5-2-1-3-6-11/h1-3,5-6,12-13,19H,4,7-10H2.
What are the key properties of 1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol?
1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol has a molecular weight of 273.30 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-[3-(trifluoromethyl)piperidin-1-yl]ethanol is sourced from PubChem (CID 3895296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).