1-[2-(trifluoromethyl)phenyl]piperidin-4-ol

C12H14F3NO — CID 55062089

IUPAC1-[2-(trifluoromethyl)phenyl]piperidin-4-ol
SMILESOC1CCN(c2ccccc2C(F)(F)F)CC1
InChIInChI=1S/C12H14F3NO/c13-12(14,15)10-3-1-2-4-11(10)16-7-5-9(17)6-8-16/h1-4,9,17H,5-8H2
InChIKeyBRFNNXWPTMQZRE-UHFFFAOYSA-N
MW245.24 g/mol
LogP2.67
Rot. Bonds1

About 1-[2-(trifluoromethyl)phenyl]piperidin-4-ol

1-[2-(trifluoromethyl)phenyl]piperidin-4-ol (PubChem CID 55062089) has the molecular formula C12H14F3NO and a molecular weight of 245.24 g/mol. Its IUPAC name is 1-[2-(trifluoromethyl)phenyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[2-(trifluoromethyl)phenyl]piperidin-4-ol
PubChem CID55062089
Molecular FormulaC12H14F3NO
Molecular Weight245.24 g/mol
Exact Mass245.10
IUPAC Name1-[2-(trifluoromethyl)phenyl]piperidin-4-ol
SMILESOC1CCN(c2ccccc2C(F)(F)F)CC1
InChIInChI=1S/C12H14F3NO/c13-12(14,15)10-3-1-2-4-11(10)16-7-5-9(17)6-8-16/h1-4,9,17H,5-8H2
InChIKeyBRFNNXWPTMQZRE-UHFFFAOYSA-N
XLogP2.67
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.24
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(trifluoromethyl)phenyl]piperidin-4-ol?
The IUPAC name of 1-[2-(trifluoromethyl)phenyl]piperidin-4-ol (CID 55062089) is 1-[2-(trifluoromethyl)phenyl]piperidin-4-ol.
What is the SMILES notation for 1-[2-(trifluoromethyl)phenyl]piperidin-4-ol?
The canonical SMILES for 1-[2-(trifluoromethyl)phenyl]piperidin-4-ol is OC1CCN(c2ccccc2C(F)(F)F)CC1.
What is the InChIKey of 1-[2-(trifluoromethyl)phenyl]piperidin-4-ol?
The InChIKey is BRFNNXWPTMQZRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F3NO/c13-12(14,15)10-3-1-2-4-11(10)16-7-5-9(17)6-8-16/h1-4,9,17H,5-8H2.
What are the key properties of 1-[2-(trifluoromethyl)phenyl]piperidin-4-ol?
1-[2-(trifluoromethyl)phenyl]piperidin-4-ol has a molecular weight of 245.24 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(trifluoromethyl)phenyl]piperidin-4-ol is sourced from PubChem (CID 55062089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).