[6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine

C9H11F3N2O — CID 66275408

IUPAC[6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine
SMILESCC(Oc1cccc(CN)n1)C(F)(F)F
InChIInChI=1S/C9H11F3N2O/c1-6(9(10,11)12)15-8-4-2-3-7(5-13)14-8/h2-4,6H,5,13H2,1H3
InChIKeyDFEOEXKDUYHCDO-UHFFFAOYSA-N
MW220.19 g/mol
LogP1.87
Rot. Bonds3

About [6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine

[6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine (PubChem CID 66275408) has the molecular formula C9H11F3N2O and a molecular weight of 220.19 g/mol. Its IUPAC name is [6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine
PubChem CID66275408
Molecular FormulaC9H11F3N2O
Molecular Weight220.19 g/mol
Exact Mass220.08
IUPAC Name[6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine
SMILESCC(Oc1cccc(CN)n1)C(F)(F)F
InChIInChI=1S/C9H11F3N2O/c1-6(9(10,11)12)15-8-4-2-3-7(5-13)14-8/h2-4,6H,5,13H2,1H3
InChIKeyDFEOEXKDUYHCDO-UHFFFAOYSA-N
XLogP1.87
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.19
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine?
The IUPAC name of [6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine (CID 66275408) is [6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine.
What is the SMILES notation for [6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine?
The canonical SMILES for [6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine is CC(Oc1cccc(CN)n1)C(F)(F)F.
What is the InChIKey of [6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine?
The InChIKey is DFEOEXKDUYHCDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N2O/c1-6(9(10,11)12)15-8-4-2-3-7(5-13)14-8/h2-4,6H,5,13H2,1H3.
What are the key properties of [6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine?
[6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methanamine has a molecular weight of 220.19 g/mol, XLogP of 1.87, 3 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)-2-pyridinyl]methanamine is sourced from PubChem (CID 66275408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).