2-(trifluoromethyl)piperidin-4-ol

C6H10F3NO — CID 53427165

IUPAC2-(trifluoromethyl)piperidin-4-ol
SMILESOC1CCNC(C(F)(F)F)C1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)5-3-4(11)1-2-10-5/h4-5,10-11H,1-3H2
InChIKeyMNFGDTYUQGCQBE-UHFFFAOYSA-N
MW169.15 g/mol
LogP0.66
Rot. Bonds

About 2-(trifluoromethyl)piperidin-4-ol

2-(trifluoromethyl)piperidin-4-ol (PubChem CID 53427165) has the molecular formula C6H10F3NO and a molecular weight of 169.15 g/mol. Its IUPAC name is 2-(trifluoromethyl)piperidin-4-ol.

Molecular Properties

Compound Name2-(trifluoromethyl)piperidin-4-ol
PubChem CID53427165
Molecular FormulaC6H10F3NO
Molecular Weight169.15 g/mol
Exact Mass169.07
IUPAC Name2-(trifluoromethyl)piperidin-4-ol
SMILESOC1CCNC(C(F)(F)F)C1
InChIInChI=1S/C6H10F3NO/c7-6(8,9)5-3-4(11)1-2-10-5/h4-5,10-11H,1-3H2
InChIKeyMNFGDTYUQGCQBE-UHFFFAOYSA-N
XLogP0.66
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 ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)piperidin-4-ol?
The IUPAC name of 2-(trifluoromethyl)piperidin-4-ol (CID 53427165) is 2-(trifluoromethyl)piperidin-4-ol.
What is the SMILES notation for 2-(trifluoromethyl)piperidin-4-ol?
The canonical SMILES for 2-(trifluoromethyl)piperidin-4-ol is OC1CCNC(C(F)(F)F)C1.
What is the InChIKey of 2-(trifluoromethyl)piperidin-4-ol?
The InChIKey is MNFGDTYUQGCQBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO/c7-6(8,9)5-3-4(11)1-2-10-5/h4-5,10-11H,1-3H2.
What are the key properties of 2-(trifluoromethyl)piperidin-4-ol?
2-(trifluoromethyl)piperidin-4-ol has a molecular weight of 169.15 g/mol, XLogP of 0.66, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)piperidin-4-ol is sourced from PubChem (CID 53427165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).