1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol

C14H24F3NO — CID 157038918

IUPAC1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol
SMILESOC1CCN(CCC2CCC(C(F)(F)F)CC2)CC1
InChIInChI=1S/C14H24F3NO/c15-14(16,17)12-3-1-11(2-4-12)5-8-18-9-6-13(19)7-10-18/h11-13,19H,1-10H2
InChIKeyBKBIWEBYFCIUDF-UHFFFAOYSA-N
MW279.35 g/mol
LogP3.20
Rot. Bonds3

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

1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol (PubChem CID 157038918) has the molecular formula C14H24F3NO and a molecular weight of 279.35 g/mol. Its IUPAC name is 1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol
PubChem CID157038918
Molecular FormulaC14H24F3NO
Molecular Weight279.35 g/mol
Exact Mass279.18
IUPAC Name1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol
SMILESOC1CCN(CCC2CCC(C(F)(F)F)CC2)CC1
InChIInChI=1S/C14H24F3NO/c15-14(16,17)12-3-1-11(2-4-12)5-8-18-9-6-13(19)7-10-18/h11-13,19H,1-10H2
InChIKeyBKBIWEBYFCIUDF-UHFFFAOYSA-N
XLogP3.20
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol?
The IUPAC name of 1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol (CID 157038918) is 1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol.
What is the SMILES notation for 1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol?
The canonical SMILES for 1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol is OC1CCN(CCC2CCC(C(F)(F)F)CC2)CC1.
What is the InChIKey of 1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol?
The InChIKey is BKBIWEBYFCIUDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F3NO/c15-14(16,17)12-3-1-11(2-4-12)5-8-18-9-6-13(19)7-10-18/h11-13,19H,1-10H2.
What are the key properties of 1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol?
1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol has a molecular weight of 279.35 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-(trifluoromethyl)cyclohexyl]ethyl]piperidin-4-ol is sourced from PubChem (CID 157038918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).