2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine

C11H11F3N4O — CID 58370430

IUPAC2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine
SMILESCc1nc(Oc2cc(C(F)(F)F)n(C)n2)ccc1N
InChIInChI=1S/C11H11F3N4O/c1-6-7(15)3-4-9(16-6)19-10-5-8(11(12,13)14)18(2)17-10/h3-5H,15H2,1-2H3
InChIKeyPRYCCOSBLXMYLG-UHFFFAOYSA-N
MW272.23 g/mol
LogP2.52
Rot. Bonds2

About 2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine

2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine (PubChem CID 58370430) has the molecular formula C11H11F3N4O and a molecular weight of 272.23 g/mol. Its IUPAC name is 2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine.

Molecular Properties

Compound Name2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine
PubChem CID58370430
Molecular FormulaC11H11F3N4O
Molecular Weight272.23 g/mol
Exact Mass272.09
IUPAC Name2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine
SMILESCc1nc(Oc2cc(C(F)(F)F)n(C)n2)ccc1N
InChIInChI=1S/C11H11F3N4O/c1-6-7(15)3-4-9(16-6)19-10-5-8(11(12,13)14)18(2)17-10/h3-5H,15H2,1-2H3
InChIKeyPRYCCOSBLXMYLG-UHFFFAOYSA-N
XLogP2.52
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.23
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine?
The IUPAC name of 2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine (CID 58370430) is 2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine.
What is the SMILES notation for 2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine?
The canonical SMILES for 2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine is Cc1nc(Oc2cc(C(F)(F)F)n(C)n2)ccc1N.
What is the InChIKey of 2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine?
The InChIKey is PRYCCOSBLXMYLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N4O/c1-6-7(15)3-4-9(16-6)19-10-5-8(11(12,13)14)18(2)17-10/h3-5H,15H2,1-2H3.
What are the key properties of 2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine?
2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine has a molecular weight of 272.23 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridin-3-amine is sourced from PubChem (CID 58370430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).