[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine

C11H11F3N4O — CID 11149948

IUPAC[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine
SMILESCn1nc(C(F)(F)F)cc1Oc1cccc(CN)n1
InChIInChI=1S/C11H11F3N4O/c1-18-10(5-8(17-18)11(12,13)14)19-9-4-2-3-7(6-15)16-9/h2-5H,6,15H2,1H3
InChIKeyGFWBMBNPLJWTKN-UHFFFAOYSA-N
MW272.23 g/mol
LogP2.08
Rot. Bonds3

About [6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine

[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine (PubChem CID 11149948) has the molecular formula C11H11F3N4O and a molecular weight of 272.23 g/mol. Its IUPAC name is [6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine
PubChem CID11149948
Molecular FormulaC11H11F3N4O
Molecular Weight272.23 g/mol
Exact Mass272.09
IUPAC Name[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine
SMILESCn1nc(C(F)(F)F)cc1Oc1cccc(CN)n1
InChIInChI=1S/C11H11F3N4O/c1-18-10(5-8(17-18)11(12,13)14)19-9-4-2-3-7(6-15)16-9/h2-5H,6,15H2,1H3
InChIKeyGFWBMBNPLJWTKN-UHFFFAOYSA-N
XLogP2.08
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.23
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine?
The IUPAC name of [6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine (CID 11149948) is [6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine.
What is the SMILES notation for [6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine?
The canonical SMILES for [6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine is Cn1nc(C(F)(F)F)cc1Oc1cccc(CN)n1.
What is the InChIKey of [6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine?
The InChIKey is GFWBMBNPLJWTKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N4O/c1-18-10(5-8(17-18)11(12,13)14)19-9-4-2-3-7(6-15)16-9/h2-5H,6,15H2,1H3.
What are the key properties of [6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine?
[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine has a molecular weight of 272.23 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxy-2-pyridinyl]methanamine is sourced from PubChem (CID 11149948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).