1-ethyl-3-(trifluoromethyl)piperidin-3-ol

C8H14F3NO — CID 89019254

IUPAC1-ethyl-3-(trifluoromethyl)piperidin-3-ol
SMILESCCN1CCCC(O)(C(F)(F)F)C1
InChIInChI=1S/C8H14F3NO/c1-2-12-5-3-4-7(13,6-12)8(9,10)11/h13H,2-6H2,1H3
InChIKeyHUIWXYGJUMREOH-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.40
Rot. Bonds1

About 1-ethyl-3-(trifluoromethyl)piperidin-3-ol

1-ethyl-3-(trifluoromethyl)piperidin-3-ol (PubChem CID 89019254) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is 1-ethyl-3-(trifluoromethyl)piperidin-3-ol.

Molecular Properties

Compound Name1-ethyl-3-(trifluoromethyl)piperidin-3-ol
PubChem CID89019254
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC Name1-ethyl-3-(trifluoromethyl)piperidin-3-ol
SMILESCCN1CCCC(O)(C(F)(F)F)C1
InChIInChI=1S/C8H14F3NO/c1-2-12-5-3-4-7(13,6-12)8(9,10)11/h13H,2-6H2,1H3
InChIKeyHUIWXYGJUMREOH-UHFFFAOYSA-N
XLogP1.40
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(trifluoromethyl)piperidin-3-ol?
The IUPAC name of 1-ethyl-3-(trifluoromethyl)piperidin-3-ol (CID 89019254) is 1-ethyl-3-(trifluoromethyl)piperidin-3-ol.
What is the SMILES notation for 1-ethyl-3-(trifluoromethyl)piperidin-3-ol?
The canonical SMILES for 1-ethyl-3-(trifluoromethyl)piperidin-3-ol is CCN1CCCC(O)(C(F)(F)F)C1.
What is the InChIKey of 1-ethyl-3-(trifluoromethyl)piperidin-3-ol?
The InChIKey is HUIWXYGJUMREOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c1-2-12-5-3-4-7(13,6-12)8(9,10)11/h13H,2-6H2,1H3.
What are the key properties of 1-ethyl-3-(trifluoromethyl)piperidin-3-ol?
1-ethyl-3-(trifluoromethyl)piperidin-3-ol has a molecular weight of 197.20 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(trifluoromethyl)piperidin-3-ol is sourced from PubChem (CID 89019254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).