6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine

C8H9F3N2O — CID 66277354

IUPAC6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine
SMILESCC(Oc1ccc(N)cn1)C(F)(F)F
InChIInChI=1S/C8H9F3N2O/c1-5(8(9,10)11)14-7-3-2-6(12)4-13-7/h2-5H,12H2,1H3
InChIKeyVTGFJMSUUYKLER-UHFFFAOYSA-N
MW206.17 g/mol
LogP1.99
Rot. Bonds2

About 6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine

6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine (PubChem CID 66277354) has the molecular formula C8H9F3N2O and a molecular weight of 206.17 g/mol. Its IUPAC name is 6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine.

Molecular Properties

Compound Name6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine
PubChem CID66277354
Molecular FormulaC8H9F3N2O
Molecular Weight206.17 g/mol
Exact Mass206.07
IUPAC Name6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine
SMILESCC(Oc1ccc(N)cn1)C(F)(F)F
InChIInChI=1S/C8H9F3N2O/c1-5(8(9,10)11)14-7-3-2-6(12)4-13-7/h2-5H,12H2,1H3
InChIKeyVTGFJMSUUYKLER-UHFFFAOYSA-N
XLogP1.99
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.17
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine?
The IUPAC name of 6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine (CID 66277354) is 6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine.
What is the SMILES notation for 6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine?
The canonical SMILES for 6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine is CC(Oc1ccc(N)cn1)C(F)(F)F.
What is the InChIKey of 6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine?
The InChIKey is VTGFJMSUUYKLER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F3N2O/c1-5(8(9,10)11)14-7-3-2-6(12)4-13-7/h2-5H,12H2,1H3.
What are the key properties of 6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine?
6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine has a molecular weight of 206.17 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1,1,1-trifluoropropan-2-yloxy)pyridin-3-amine is sourced from PubChem (CID 66277354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).