1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine

C12H14F3NO — CID 54157948

IUPAC1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine
SMILESON1CCC(c2ccc(C(F)(F)F)cc2)CC1
InChIInChI=1S/C12H14F3NO/c13-12(14,15)11-3-1-9(2-4-11)10-5-7-16(17)8-6-10/h1-4,10,17H,5-8H2
InChIKeyOMJYSCVOLMGCSU-UHFFFAOYSA-N
MW245.24 g/mol
LogP3.27
Rot. Bonds1

About 1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine

1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine (PubChem CID 54157948) has the molecular formula C12H14F3NO and a molecular weight of 245.24 g/mol. Its IUPAC name is 1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine.

Molecular Properties

Compound Name1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine
PubChem CID54157948
Molecular FormulaC12H14F3NO
Molecular Weight245.24 g/mol
Exact Mass245.10
IUPAC Name1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine
SMILESON1CCC(c2ccc(C(F)(F)F)cc2)CC1
InChIInChI=1S/C12H14F3NO/c13-12(14,15)11-3-1-9(2-4-11)10-5-7-16(17)8-6-10/h1-4,10,17H,5-8H2
InChIKeyOMJYSCVOLMGCSU-UHFFFAOYSA-N
XLogP3.27
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 ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine?
The IUPAC name of 1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine (CID 54157948) is 1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine.
What is the SMILES notation for 1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine?
The canonical SMILES for 1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine is ON1CCC(c2ccc(C(F)(F)F)cc2)CC1.
What is the InChIKey of 1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine?
The InChIKey is OMJYSCVOLMGCSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F3NO/c13-12(14,15)11-3-1-9(2-4-11)10-5-7-16(17)8-6-10/h1-4,10,17H,5-8H2.
What are the key properties of 1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine?
1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine has a molecular weight of 245.24 g/mol, XLogP of 3.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-4-[4-(trifluoromethyl)phenyl]piperidine is sourced from PubChem (CID 54157948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).