6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine

C13H10F4N2O — CID 102989067

IUPAC6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine
SMILESCc1ccc(F)cc1Oc1cc(C(F)(F)F)cc(N)n1
InChIInChI=1S/C13H10F4N2O/c1-7-2-3-9(14)6-10(7)20-12-5-8(13(15,16)17)4-11(18)19-12/h2-6H,1H3,(H2,18,19)
InChIKeyNLMLTZLKPPDDSP-UHFFFAOYSA-N
MW286.23 g/mol
LogP3.92
Rot. Bonds2

About 6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine

6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102989067) has the molecular formula C13H10F4N2O and a molecular weight of 286.23 g/mol. Its IUPAC name is 6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102989067
Molecular FormulaC13H10F4N2O
Molecular Weight286.23 g/mol
Exact Mass286.07
IUPAC Name6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine
SMILESCc1ccc(F)cc1Oc1cc(C(F)(F)F)cc(N)n1
InChIInChI=1S/C13H10F4N2O/c1-7-2-3-9(14)6-10(7)20-12-5-8(13(15,16)17)4-11(18)19-12/h2-6H,1H3,(H2,18,19)
InChIKeyNLMLTZLKPPDDSP-UHFFFAOYSA-N
XLogP3.92
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.23
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine (CID 102989067) is 6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine is Cc1ccc(F)cc1Oc1cc(C(F)(F)F)cc(N)n1.
What is the InChIKey of 6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is NLMLTZLKPPDDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F4N2O/c1-7-2-3-9(14)6-10(7)20-12-5-8(13(15,16)17)4-11(18)19-12/h2-6H,1H3,(H2,18,19).
What are the key properties of 6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine?
6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 286.23 g/mol, XLogP of 3.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102989067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).