4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine

C9H8F6N2O — CID 102720032

IUPAC4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine
SMILESCC(Oc1cc(C(F)(F)F)cc(N)n1)C(F)(F)F
InChIInChI=1S/C9H8F6N2O/c1-4(8(10,11)12)18-7-3-5(9(13,14)15)2-6(16)17-7/h2-4H,1H3,(H2,16,17)
InChIKeyFXRXCDZDVVLZEK-UHFFFAOYSA-N
MW274.16 g/mol
LogP3.01
Rot. Bonds2

About 4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine

4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine (PubChem CID 102720032) has the molecular formula C9H8F6N2O and a molecular weight of 274.16 g/mol. Its IUPAC name is 4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine.

Molecular Properties

Compound Name4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine
PubChem CID102720032
Molecular FormulaC9H8F6N2O
Molecular Weight274.16 g/mol
Exact Mass274.05
IUPAC Name4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine
SMILESCC(Oc1cc(C(F)(F)F)cc(N)n1)C(F)(F)F
InChIInChI=1S/C9H8F6N2O/c1-4(8(10,11)12)18-7-3-5(9(13,14)15)2-6(16)17-7/h2-4H,1H3,(H2,16,17)
InChIKeyFXRXCDZDVVLZEK-UHFFFAOYSA-N
XLogP3.01
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.16
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-hexoxy-4-(trifluoromethyl)pyridin-2-amine
CID 102719653
6-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-4-amine
CID 80877295
6-(1-propan-2-ylpyrazol-4-yl)oxy-4-(trifluoromethyl)pyridin-2-amine
CID 102720115
6-(5-fluoro-2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102989067
6-(2,6-dimethyloxan-4-yl)oxy-4-(trifluoromethyl)pyridin-2-amine
CID 102720096
6-bromo-2-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-4-amine
CID 116797954
6-N-propan-2-yl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717244
4-chloro-2-methyl-6-(1,1,1-trifluoropropan-2-yloxy)pyrimidine
CID 66277825
3-[[6-amino-4-(trifluoromethyl)-2-pyridinyl]oxy]propan-1-ol
CID 102719752
6-but-3-ynoxy-4-(trifluoromethyl)pyridin-2-amine
CID 106795472
6-(3-methylbutan-2-ylsulfanyl)-4-(trifluoromethyl)pyridin-2-amine
CID 107765534
6-(4-bromo-3-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102720089

Frequently Asked Questions

What is the IUPAC name of 4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine?
The IUPAC name of 4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine (CID 102720032) is 4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine.
What is the SMILES notation for 4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine?
The canonical SMILES for 4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine is CC(Oc1cc(C(F)(F)F)cc(N)n1)C(F)(F)F.
What is the InChIKey of 4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine?
The InChIKey is FXRXCDZDVVLZEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F6N2O/c1-4(8(10,11)12)18-7-3-5(9(13,14)15)2-6(16)17-7/h2-4H,1H3,(H2,16,17).
What are the key properties of 4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine?
4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine has a molecular weight of 274.16 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(trifluoromethyl)-6-(1,1,1-trifluoropropan-2-yloxy)pyridin-2-amine is sourced from PubChem (CID 102720032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).