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

C11H9F3N4O — CID 156809050

IUPAC3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine
SMILESCOc1cc(-c2ncc(C(F)(F)F)nc2N)ccn1
InChIInChI=1S/C11H9F3N4O/c1-19-8-4-6(2-3-16-8)9-10(15)18-7(5-17-9)11(12,13)14/h2-5H,1H3,(H2,15,18)
InChIKeyOCVUYMHLTVKATB-UHFFFAOYSA-N
MW270.21 g/mol
LogP2.15
Rot. Bonds2

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

3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine (PubChem CID 156809050) has the molecular formula C11H9F3N4O and a molecular weight of 270.21 g/mol. Its IUPAC name is 3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine.

Molecular Properties

Compound Name3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine
PubChem CID156809050
Molecular FormulaC11H9F3N4O
Molecular Weight270.21 g/mol
Exact Mass270.07
IUPAC Name3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine
SMILESCOc1cc(-c2ncc(C(F)(F)F)nc2N)ccn1
InChIInChI=1S/C11H9F3N4O/c1-19-8-4-6(2-3-16-8)9-10(15)18-7(5-17-9)11(12,13)14/h2-5H,1H3,(H2,15,18)
InChIKeyOCVUYMHLTVKATB-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

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine?
The IUPAC name of 3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine (CID 156809050) is 3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine.
What is the SMILES notation for 3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine?
The canonical SMILES for 3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine is COc1cc(-c2ncc(C(F)(F)F)nc2N)ccn1.
What is the InChIKey of 3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine?
The InChIKey is OCVUYMHLTVKATB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N4O/c1-19-8-4-6(2-3-16-8)9-10(15)18-7(5-17-9)11(12,13)14/h2-5H,1H3,(H2,15,18).
What are the key properties of 3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine?
3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-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 3-(2-methoxy-4-pyridinyl)-6-(trifluoromethyl)pyrazin-2-amine is sourced from PubChem (CID 156809050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).