[1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol

C8H14F3NO — CID 62022536

IUPAC[1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol
SMILESOCC1CCCN(CC(F)(F)F)C1
InChIInChI=1S/C8H14F3NO/c9-8(10,11)6-12-3-1-2-7(4-12)5-13/h7,13H,1-6H2
InChIKeyHCHMELHRMTYUIH-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.25
Rot. Bonds2

About [1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol

[1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol (PubChem CID 62022536) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is [1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol
PubChem CID62022536
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC Name[1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol
SMILESOCC1CCCN(CC(F)(F)F)C1
InChIInChI=1S/C8H14F3NO/c9-8(10,11)6-12-3-1-2-7(4-12)5-13/h7,13H,1-6H2
InChIKeyHCHMELHRMTYUIH-UHFFFAOYSA-N
XLogP1.25
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol?
The IUPAC name of [1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol (CID 62022536) is [1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol.
What is the SMILES notation for [1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol?
The canonical SMILES for [1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol is OCC1CCCN(CC(F)(F)F)C1.
What is the InChIKey of [1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol?
The InChIKey is HCHMELHRMTYUIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c9-8(10,11)6-12-3-1-2-7(4-12)5-13/h7,13H,1-6H2.
What are the key properties of [1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol?
[1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol has a molecular weight of 197.20 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,2,2-trifluoroethyl)piperidin-3-yl]methanol is sourced from PubChem (CID 62022536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).