6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine

C11H9F3N4O — CID 106769319

IUPAC6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine
SMILESCOc1ccc(-c2cc(N)nc(C(F)(F)F)n2)cn1
InChIInChI=1S/C11H9F3N4O/c1-19-9-3-2-6(5-16-9)7-4-8(15)18-10(17-7)11(12,13)14/h2-5H,1H3,(H2,15,17,18)
InChIKeyPAGITXRDDXFRII-UHFFFAOYSA-N
MW270.21 g/mol
LogP2.15
Rot. Bonds2

About 6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine

6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine (PubChem CID 106769319) has the molecular formula C11H9F3N4O and a molecular weight of 270.21 g/mol. Its IUPAC name is 6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine
PubChem CID106769319
Molecular FormulaC11H9F3N4O
Molecular Weight270.21 g/mol
Exact Mass270.07
IUPAC Name6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine
SMILESCOc1ccc(-c2cc(N)nc(C(F)(F)F)n2)cn1
InChIInChI=1S/C11H9F3N4O/c1-19-9-3-2-6(5-16-9)7-4-8(15)18-10(17-7)11(12,13)14/h2-5H,1H3,(H2,15,17,18)
InChIKeyPAGITXRDDXFRII-UHFFFAOYSA-N
XLogP2.15
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.21
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine 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-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine?
The IUPAC name of 6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine (CID 106769319) is 6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine?
The canonical SMILES for 6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine is COc1ccc(-c2cc(N)nc(C(F)(F)F)n2)cn1.
What is the InChIKey of 6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine?
The InChIKey is PAGITXRDDXFRII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N4O/c1-19-9-3-2-6(5-16-9)7-4-8(15)18-10(17-7)11(12,13)14/h2-5H,1H3,(H2,15,17,18).
What are the key properties of 6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine?
6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine has a molecular weight of 270.21 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)pyrimidin-4-amine is sourced from PubChem (CID 106769319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).