4-methyl-2-(trifluoromethyl)piperidin-4-ol

C7H12F3NO — CID 178143279

IUPAC4-methyl-2-(trifluoromethyl)piperidin-4-ol
SMILESCC1(O)CCNC(C(F)(F)F)C1
InChIInChI=1S/C7H12F3NO/c1-6(12)2-3-11-5(4-6)7(8,9)10/h5,11-12H,2-4H2,1H3
InChIKeyAPZXBISFJOIUMH-UHFFFAOYSA-N
MW183.17 g/mol
LogP1.05
Rot. Bonds

About 4-methyl-2-(trifluoromethyl)piperidin-4-ol

4-methyl-2-(trifluoromethyl)piperidin-4-ol (PubChem CID 178143279) has the molecular formula C7H12F3NO and a molecular weight of 183.17 g/mol. Its IUPAC name is 4-methyl-2-(trifluoromethyl)piperidin-4-ol.

Molecular Properties

Compound Name4-methyl-2-(trifluoromethyl)piperidin-4-ol
PubChem CID178143279
Molecular FormulaC7H12F3NO
Molecular Weight183.17 g/mol
Exact Mass183.09
IUPAC Name4-methyl-2-(trifluoromethyl)piperidin-4-ol
SMILESCC1(O)CCNC(C(F)(F)F)C1
InChIInChI=1S/C7H12F3NO/c1-6(12)2-3-11-5(4-6)7(8,9)10/h5,11-12H,2-4H2,1H3
InChIKeyAPZXBISFJOIUMH-UHFFFAOYSA-N
XLogP1.05
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(trifluoromethyl)piperidin-4-ol?
The IUPAC name of 4-methyl-2-(trifluoromethyl)piperidin-4-ol (CID 178143279) is 4-methyl-2-(trifluoromethyl)piperidin-4-ol.
What is the SMILES notation for 4-methyl-2-(trifluoromethyl)piperidin-4-ol?
The canonical SMILES for 4-methyl-2-(trifluoromethyl)piperidin-4-ol is CC1(O)CCNC(C(F)(F)F)C1.
What is the InChIKey of 4-methyl-2-(trifluoromethyl)piperidin-4-ol?
The InChIKey is APZXBISFJOIUMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F3NO/c1-6(12)2-3-11-5(4-6)7(8,9)10/h5,11-12H,2-4H2,1H3.
What are the key properties of 4-methyl-2-(trifluoromethyl)piperidin-4-ol?
4-methyl-2-(trifluoromethyl)piperidin-4-ol has a molecular weight of 183.17 g/mol, XLogP of 1.05, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(trifluoromethyl)piperidin-4-ol is sourced from PubChem (CID 178143279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).