4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol

C12H20F3NO — CID 44228933

IUPAC4-[3-(trifluoromethyl)cyclohexyl]piperidin-4-ol
SMILESC1CC(CC(C1)C(F)(F)F)C2(CCNCC2)O
InChIInChI=1S/C12H20F3NO/c13-12(14,15)10-3-1-2-9(8-10)11(17)4-6-16-7-5-11/h9-10,16-17H,1-8H2
InChIKeyKDYQYHARSRSFGJ-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.50
Rot. Bonds1

About 4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol

4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol (PubChem CID 44228933) has the molecular formula C12H20F3NO and a molecular weight of 251.29 g/mol. Its IUPAC name is 4-[3-(trifluoromethyl)cyclohexyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol
PubChem CID44228933
Molecular FormulaC12H20F3NO
Molecular Weight251.29 g/mol
Exact Mass251.15
IUPAC Name4-[3-(trifluoromethyl)cyclohexyl]piperidin-4-ol
SMILESC1CC(CC(C1)C(F)(F)F)C2(CCNCC2)O
InChIInChI=1S/C12H20F3NO/c13-12(14,15)10-3-1-2-9(8-10)11(17)4-6-16-7-5-11/h9-10,16-17H,1-8H2
InChIKeyKDYQYHARSRSFGJ-UHFFFAOYSA-N
XLogP2.50
TPSA32.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity261

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-Cyclohexyl-4-Piperidinol
CID 44598718
1-((Piperidin-2-yl)methyl)cyclohexan-1-ol
CID 68606633
4-(2,2-Difluoroethyl)-11-methyl-2-azaspiro[5.5]undecan-11-ol
CID 123475732
9-(Trifluoromethyl)-3-azabicyclo[3.3.1]nonan-9-ol
CID 50990609
10-(Trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol
CID 50990611
(1R,5S)-9-(trifluoromethyl)-3-azabicyclo[3.3.1]nonan-9-ol
CID 52420898
(1R,6S)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol
CID 52420902
5,5,5-Trifluoro-2-piperidin-3-ylpentan-2-ol
CID 64566989
1-Piperidin-2-yl-3-(trifluoromethyl)cyclohexan-1-ol
CID 64757430
1-(4-Methylpiperidin-2-yl)-3-(trifluoromethyl)cyclohexan-1-ol
CID 64758040
1-(4-Ethylpiperidin-2-yl)-3-(trifluoromethyl)cyclohexan-1-ol
CID 64758242
4-Amino-2-cyclohexyl-1,1,1-trifluorobutan-2-ol
CID 83917999

Frequently Asked Questions

What is the IUPAC name of 4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol?
The IUPAC name of 4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol (CID 44228933) is 4-[3-(trifluoromethyl)cyclohexyl]piperidin-4-ol.
What is the SMILES notation for 4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol?
The canonical SMILES for 4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol is C1CC(CC(C1)C(F)(F)F)C2(CCNCC2)O.
What is the InChIKey of 4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol?
The InChIKey is KDYQYHARSRSFGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20F3NO/c13-12(14,15)10-3-1-2-9(8-10)11(17)4-6-16-7-5-11/h9-10,16-17H,1-8H2.
What are the key properties of 4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol?
4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol has a molecular weight of 251.29 g/mol, XLogP of 2.50, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(Trifluoromethyl)cyclohexyl]piperidin-4-ol is sourced from PubChem (CID 44228933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).