1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane

C14H26F3NO — CID 155721197

IUPAC1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane
SMILESCC1CC(O)CCN1C.FC(F)(F)C1CCCCC1
InChIInChI=1S/C7H11F3.C7H15NO/c8-7(9,10)6-4-2-1-3-5-6;1-6-5-7(9)3-4-8(6)2/h6H,1-5H2;6-7,9H,3-5H2,1-2H3
InChIKeySLBUWAPAMYMPCS-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.59
Rot. Bonds

About 1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane

1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane (PubChem CID 155721197) has the molecular formula C14H26F3NO and a molecular weight of 281.36 g/mol. Its IUPAC name is 1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane.

Molecular Properties

Compound Name1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane
PubChem CID155721197
Molecular FormulaC14H26F3NO
Molecular Weight281.36 g/mol
Exact Mass281.20
IUPAC Name1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane
SMILESCC1CC(O)CCN1C.FC(F)(F)C1CCCCC1
InChIInChI=1S/C7H11F3.C7H15NO/c8-7(9,10)6-4-2-1-3-5-6;1-6-5-7(9)3-4-8(6)2/h6H,1-5H2;6-7,9H,3-5H2,1-2H3
InChIKeySLBUWAPAMYMPCS-UHFFFAOYSA-N
XLogP3.59
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane?
The IUPAC name of 1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane (CID 155721197) is 1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane.
What is the SMILES notation for 1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane?
The canonical SMILES for 1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane is CC1CC(O)CCN1C.FC(F)(F)C1CCCCC1.
What is the InChIKey of 1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane?
The InChIKey is SLBUWAPAMYMPCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3.C7H15NO/c8-7(9,10)6-4-2-1-3-5-6;1-6-5-7(9)3-4-8(6)2/h6H,1-5H2;6-7,9H,3-5H2,1-2H3.
What are the key properties of 1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane?
1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane has a molecular weight of 281.36 g/mol, XLogP of 3.59, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethylpiperidin-4-ol;trifluoromethylcyclohexane is sourced from PubChem (CID 155721197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).