5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine

C19H15F2N5O2 — CID 126714416

IUPAC5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOCC(F)(F)c1ccc(Oc2ncccc2-c2cccc3ncnn23)cn1
InChIInChI=1S/C19H15F2N5O2/c1-27-11-19(20,21)16-8-7-13(10-23-16)28-18-14(4-3-9-22-18)15-5-2-6-17-24-12-25-26(15)17/h2-10,12H,11H2,1H3
InChIKeyITGLHNXBYIIZPF-UHFFFAOYSA-N
MW383.36 g/mol
LogP3.72
Rot. Bonds6

About 5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine

5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 126714416) has the molecular formula C19H15F2N5O2 and a molecular weight of 383.36 g/mol. Its IUPAC name is 5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID126714416
Molecular FormulaC19H15F2N5O2
Molecular Weight383.36 g/mol
Exact Mass383.12
IUPAC Name5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOCC(F)(F)c1ccc(Oc2ncccc2-c2cccc3ncnn23)cn1
InChIInChI=1S/C19H15F2N5O2/c1-27-11-19(20,21)16-8-7-13(10-23-16)28-18-14(4-3-9-22-18)15-5-2-6-17-24-12-25-26(15)17/h2-10,12H,11H2,1H3
InChIKeyITGLHNXBYIIZPF-UHFFFAOYSA-N
XLogP3.72
TPSA74.43 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.36
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine (CID 126714416) is 5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine is COCC(F)(F)c1ccc(Oc2ncccc2-c2cccc3ncnn23)cn1.
What is the InChIKey of 5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is ITGLHNXBYIIZPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2N5O2/c1-27-11-19(20,21)16-8-7-13(10-23-16)28-18-14(4-3-9-22-18)15-5-2-6-17-24-12-25-26(15)17/h2-10,12H,11H2,1H3.
What are the key properties of 5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 383.36 g/mol, XLogP of 3.72, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 126714416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).