1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine

C12H16F3N3O — CID 12760111

IUPAC1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine
SMILESNC1CCN(c2cccc(OCC(F)(F)F)n2)CC1
InChIInChI=1S/C12H16F3N3O/c13-12(14,15)8-19-11-3-1-2-10(17-11)18-6-4-9(16)5-7-18/h1-3,9H,4-8,16H2
InChIKeyRIZFFNOXNZBTOR-UHFFFAOYSA-N
MW275.27 g/mol
LogP1.95
Rot. Bonds3

About 1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine

1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine (PubChem CID 12760111) has the molecular formula C12H16F3N3O and a molecular weight of 275.27 g/mol. Its IUPAC name is 1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine
PubChem CID12760111
Molecular FormulaC12H16F3N3O
Molecular Weight275.27 g/mol
Exact Mass275.12
IUPAC Name1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine
SMILESNC1CCN(c2cccc(OCC(F)(F)F)n2)CC1
InChIInChI=1S/C12H16F3N3O/c13-12(14,15)8-19-11-3-1-2-10(17-11)18-6-4-9(16)5-7-18/h1-3,9H,4-8,16H2
InChIKeyRIZFFNOXNZBTOR-UHFFFAOYSA-N
XLogP1.95
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.27
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine?
The IUPAC name of 1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine (CID 12760111) is 1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine.
What is the SMILES notation for 1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine?
The canonical SMILES for 1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine is NC1CCN(c2cccc(OCC(F)(F)F)n2)CC1.
What is the InChIKey of 1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine?
The InChIKey is RIZFFNOXNZBTOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F3N3O/c13-12(14,15)8-19-11-3-1-2-10(17-11)18-6-4-9(16)5-7-18/h1-3,9H,4-8,16H2.
What are the key properties of 1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine?
1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine has a molecular weight of 275.27 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]piperidin-4-amine is sourced from PubChem (CID 12760111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).