7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine

C20H16F2N4O2 — CID 135235659

IUPAC7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine
SMILESCOCC(F)(F)c1ccc(Oc2ncccc2-c2cccc3ccnn23)cn1
InChIInChI=1S/C20H16F2N4O2/c1-27-13-20(21,22)18-8-7-15(12-24-18)28-19-16(5-3-10-23-19)17-6-2-4-14-9-11-25-26(14)17/h2-12H,13H2,1H3
InChIKeyGQCSTRNZEZKDMR-UHFFFAOYSA-N
MW382.37 g/mol
LogP4.32
Rot. Bonds6

About 7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine

7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine (PubChem CID 135235659) has the molecular formula C20H16F2N4O2 and a molecular weight of 382.37 g/mol. Its IUPAC name is 7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine
PubChem CID135235659
Molecular FormulaC20H16F2N4O2
Molecular Weight382.37 g/mol
Exact Mass382.12
IUPAC Name7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine
SMILESCOCC(F)(F)c1ccc(Oc2ncccc2-c2cccc3ccnn23)cn1
InChIInChI=1S/C20H16F2N4O2/c1-27-13-20(21,22)18-8-7-15(12-24-18)28-19-16(5-3-10-23-19)17-6-2-4-14-9-11-25-26(14)17/h2-12H,13H2,1H3
InChIKeyGQCSTRNZEZKDMR-UHFFFAOYSA-N
XLogP4.32
TPSA61.54 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.37
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine?
The IUPAC name of 7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine (CID 135235659) is 7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine?
The canonical SMILES for 7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine is COCC(F)(F)c1ccc(Oc2ncccc2-c2cccc3ccnn23)cn1.
What is the InChIKey of 7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine?
The InChIKey is GQCSTRNZEZKDMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F2N4O2/c1-27-13-20(21,22)18-8-7-15(12-24-18)28-19-16(5-3-10-23-19)17-6-2-4-14-9-11-25-26(14)17/h2-12H,13H2,1H3.
What are the key properties of 7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine?
7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine has a molecular weight of 382.37 g/mol, XLogP of 4.32, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-[[6-(1,1-difluoro-2-methoxyethyl)-3-pyridinyl]oxy]-3-pyridinyl]pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 135235659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).