(3S)-5-(trifluoromethyl)piperidin-3-ol

C6H10F3NO — CID 126716191

IUPAC(3S)-5-(trifluoromethyl)piperidin-3-ol
SMILESO[C@@H]1CNCC(C(F)(F)F)C1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)4-1-5(11)3-10-2-4/h4-5,10-11H,1-3H2/t4?,5-/m0/s1
InChIKeyZNWMHVACINVUCM-AKGZTFGVSA-N
MW169.15 g/mol
LogP0.52
Rot. Bonds

About (3S)-5-(trifluoromethyl)piperidin-3-ol

(3S)-5-(trifluoromethyl)piperidin-3-ol (PubChem CID 126716191) has the molecular formula C6H10F3NO and a molecular weight of 169.15 g/mol. Its IUPAC name is (3S)-5-(trifluoromethyl)piperidin-3-ol.

Molecular Properties

Compound Name(3S)-5-(trifluoromethyl)piperidin-3-ol
PubChem CID126716191
Molecular FormulaC6H10F3NO
Molecular Weight169.15 g/mol
Exact Mass169.07
IUPAC Name(3S)-5-(trifluoromethyl)piperidin-3-ol
SMILESO[C@@H]1CNCC(C(F)(F)F)C1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)4-1-5(11)3-10-2-4/h4-5,10-11H,1-3H2/t4?,5-/m0/s1
InChIKeyZNWMHVACINVUCM-AKGZTFGVSA-N
XLogP0.52
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.15
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3S)-5-(trifluoromethyl)piperidin-3-ol?
The IUPAC name of (3S)-5-(trifluoromethyl)piperidin-3-ol (CID 126716191) is (3S)-5-(trifluoromethyl)piperidin-3-ol.
What is the SMILES notation for (3S)-5-(trifluoromethyl)piperidin-3-ol?
The canonical SMILES for (3S)-5-(trifluoromethyl)piperidin-3-ol is O[C@@H]1CNCC(C(F)(F)F)C1.
What is the InChIKey of (3S)-5-(trifluoromethyl)piperidin-3-ol?
The InChIKey is ZNWMHVACINVUCM-AKGZTFGVSA-N. The full InChI is InChI=1S/C6H10F3NO/c7-6(8,9)4-1-5(11)3-10-2-4/h4-5,10-11H,1-3H2/t4?,5-/m0/s1.
What are the key properties of (3S)-5-(trifluoromethyl)piperidin-3-ol?
(3S)-5-(trifluoromethyl)piperidin-3-ol has a molecular weight of 169.15 g/mol, XLogP of 0.52, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-5-(trifluoromethyl)piperidin-3-ol is sourced from PubChem (CID 126716191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).