2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol

C14H24F3NO — CID 79847456

IUPAC2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol
SMILESCC1(C)CCCC(N2CCCC(C(F)(F)F)C2)C1O
InChIInChI=1S/C14H24F3NO/c1-13(2)7-3-6-11(12(13)19)18-8-4-5-10(9-18)14(15,16)17/h10-12,19H,3-9H2,1-2H3
InChIKeyFRFIQSUJOYITGC-UHFFFAOYSA-N
MW279.35 g/mol
LogP3.20
Rot. Bonds1

About 2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol

2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol (PubChem CID 79847456) has the molecular formula C14H24F3NO and a molecular weight of 279.35 g/mol. Its IUPAC name is 2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol
PubChem CID79847456
Molecular FormulaC14H24F3NO
Molecular Weight279.35 g/mol
Exact Mass279.18
IUPAC Name2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol
SMILESCC1(C)CCCC(N2CCCC(C(F)(F)F)C2)C1O
InChIInChI=1S/C14H24F3NO/c1-13(2)7-3-6-11(12(13)19)18-8-4-5-10(9-18)14(15,16)17/h10-12,19H,3-9H2,1-2H3
InChIKeyFRFIQSUJOYITGC-UHFFFAOYSA-N
XLogP3.20
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
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 2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol?
The IUPAC name of 2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol (CID 79847456) is 2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol.
What is the SMILES notation for 2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol?
The canonical SMILES for 2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol is CC1(C)CCCC(N2CCCC(C(F)(F)F)C2)C1O.
What is the InChIKey of 2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol?
The InChIKey is FRFIQSUJOYITGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F3NO/c1-13(2)7-3-6-11(12(13)19)18-8-4-5-10(9-18)14(15,16)17/h10-12,19H,3-9H2,1-2H3.
What are the key properties of 2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol?
2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol has a molecular weight of 279.35 g/mol, XLogP of 3.20, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-ol is sourced from PubChem (CID 79847456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).