2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine

C8H9F3N2O — CID 156817567

IUPAC2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine
SMILESNCCc1ccc(OC(F)(F)F)nc1
InChIInChI=1S/C8H9F3N2O/c9-8(10,11)14-7-2-1-6(3-4-12)5-13-7/h1-2,5H,3-4,12H2
InChIKeyGXSGBDDOAYAHIP-UHFFFAOYSA-N
MW206.17 g/mol
LogP1.48
Rot. Bonds3

About 2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine

2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine (PubChem CID 156817567) has the molecular formula C8H9F3N2O and a molecular weight of 206.17 g/mol. Its IUPAC name is 2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine.

Molecular Properties

Compound Name2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine
PubChem CID156817567
Molecular FormulaC8H9F3N2O
Molecular Weight206.17 g/mol
Exact Mass206.07
IUPAC Name2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine
SMILESNCCc1ccc(OC(F)(F)F)nc1
InChIInChI=1S/C8H9F3N2O/c9-8(10,11)14-7-2-1-6(3-4-12)5-13-7/h1-2,5H,3-4,12H2
InChIKeyGXSGBDDOAYAHIP-UHFFFAOYSA-N
XLogP1.48
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.17
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-(2,2-difluoroethoxy)-3-pyridinyl]ethanamine
CID 87770733
2-[6-(4-tert-butylphenoxy)-3-pyridinyl]ethanamine
CID 80640150
2-(6-fluoro-3-pyridinyl)ethanamine
CID 55253622
2-[6-(2,3-dimethylphenoxy)-3-pyridinyl]ethanamine
CID 80640428
2-(6-pyridin-3-yloxy-3-pyridinyl)ethanamine
CID 80640422
2,5-bis(trifluoromethoxy)pyrazine
CID 119084225
2-[6-[(6-methyl-3-pyridinyl)oxy]-3-pyridinyl]ethanamine
CID 80640346
2-[6-(2-methoxyphenoxy)-3-pyridinyl]ethanamine
CID 80639711
2-[6-[4-(2-methylbutan-2-yl)phenoxy]-3-pyridinyl]ethanamine
CID 80626968
2-[6-(2,3-dichlorophenoxy)-3-pyridinyl]ethanamine
CID 80639795
4-(2-aminoethyl)-2-(trifluoromethoxy)phenol
CID 170868556
2-[6-(3-iodophenoxy)-3-pyridinyl]ethanamine
CID 80639888

Frequently Asked Questions

What is the IUPAC name of 2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine?
The IUPAC name of 2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine (CID 156817567) is 2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine.
What is the SMILES notation for 2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine?
The canonical SMILES for 2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine is NCCc1ccc(OC(F)(F)F)nc1.
What is the InChIKey of 2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine?
The InChIKey is GXSGBDDOAYAHIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F3N2O/c9-8(10,11)14-7-2-1-6(3-4-12)5-13-7/h1-2,5H,3-4,12H2.
What are the key properties of 2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine?
2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine has a molecular weight of 206.17 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(trifluoromethoxy)-3-pyridinyl]ethanamine is sourced from PubChem (CID 156817567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).