2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide

C15H11F2N3O — CID 90569517

IUPAC2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1cc2ccccn2n1)c1c(F)cccc1F
InChIInChI=1S/C15H11F2N3O/c16-12-5-3-6-13(17)14(12)15(21)18-9-10-8-11-4-1-2-7-20(11)19-10/h1-8H,9H2,(H,18,21)
InChIKeyCKJZEUOLUQJXPP-UHFFFAOYSA-N
MW287.27 g/mol
LogP2.54
Rot. Bonds3

About 2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide

2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide (PubChem CID 90569517) has the molecular formula C15H11F2N3O and a molecular weight of 287.27 g/mol. Its IUPAC name is 2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide
PubChem CID90569517
Molecular FormulaC15H11F2N3O
Molecular Weight287.27 g/mol
Exact Mass287.09
IUPAC Name2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1cc2ccccn2n1)c1c(F)cccc1F
InChIInChI=1S/C15H11F2N3O/c16-12-5-3-6-13(17)14(12)15(21)18-9-10-8-11-4-1-2-7-20(11)19-10/h1-8H,9H2,(H,18,21)
InChIKeyCKJZEUOLUQJXPP-UHFFFAOYSA-N
XLogP2.54
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.27
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide?
The IUPAC name of 2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide (CID 90569517) is 2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide is O=C(NCc1cc2ccccn2n1)c1c(F)cccc1F.
What is the InChIKey of 2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide?
The InChIKey is CKJZEUOLUQJXPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F2N3O/c16-12-5-3-6-13(17)14(12)15(21)18-9-10-8-11-4-1-2-7-20(11)19-10/h1-8H,9H2,(H,18,21).
What are the key properties of 2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide?
2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide has a molecular weight of 287.27 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 90569517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).