2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine

C14H19F3N2O — CID 135135050

IUPAC2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine
SMILESCc1cc(OCC2CNCC(C(F)(F)F)C2)cc(C)n1
InChIInChI=1S/C14H19F3N2O/c1-9-3-13(4-10(2)19-9)20-8-11-5-12(7-18-6-11)14(15,16)17/h3-4,11-12,18H,5-8H2,1-2H3
InChIKeyARKVXLZSTWUVGS-UHFFFAOYSA-N
MW288.31 g/mol
LogP2.87
Rot. Bonds3

About 2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine

2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine (PubChem CID 135135050) has the molecular formula C14H19F3N2O and a molecular weight of 288.31 g/mol. Its IUPAC name is 2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine.

Molecular Properties

Compound Name2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine
PubChem CID135135050
Molecular FormulaC14H19F3N2O
Molecular Weight288.31 g/mol
Exact Mass288.14
IUPAC Name2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine
SMILESCc1cc(OCC2CNCC(C(F)(F)F)C2)cc(C)n1
InChIInChI=1S/C14H19F3N2O/c1-9-3-13(4-10(2)19-9)20-8-11-5-12(7-18-6-11)14(15,16)17/h3-4,11-12,18H,5-8H2,1-2H3
InChIKeyARKVXLZSTWUVGS-UHFFFAOYSA-N
XLogP2.87
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine?
The IUPAC name of 2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine (CID 135135050) is 2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine.
What is the SMILES notation for 2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine?
The canonical SMILES for 2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine is Cc1cc(OCC2CNCC(C(F)(F)F)C2)cc(C)n1.
What is the InChIKey of 2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine?
The InChIKey is ARKVXLZSTWUVGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2O/c1-9-3-13(4-10(2)19-9)20-8-11-5-12(7-18-6-11)14(15,16)17/h3-4,11-12,18H,5-8H2,1-2H3.
What are the key properties of 2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine?
2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine has a molecular weight of 288.31 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-[[5-(trifluoromethyl)piperidin-3-yl]methoxy]pyridine is sourced from PubChem (CID 135135050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).