6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine

C18H13FN4 — CID 90095810

IUPAC6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine
SMILESCc1cc(-c2ncccc2-c2cnc3cn[nH]c3c2)ccc1F
InChIInChI=1S/C18H13FN4/c1-11-7-12(4-5-15(11)19)18-14(3-2-6-20-18)13-8-16-17(21-9-13)10-22-23-16/h2-10H,1H3,(H,22,23)
InChIKeyHXXCUFZVFZBETC-UHFFFAOYSA-N
MW304.33 g/mol
LogP4.13
Rot. Bonds2

About 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine

6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine (PubChem CID 90095810) has the molecular formula C18H13FN4 and a molecular weight of 304.33 g/mol. Its IUPAC name is 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine.

Molecular Properties

Compound Name6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine
PubChem CID90095810
Molecular FormulaC18H13FN4
Molecular Weight304.33 g/mol
Exact Mass304.11
IUPAC Name6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine
SMILESCc1cc(-c2ncccc2-c2cnc3cn[nH]c3c2)ccc1F
InChIInChI=1S/C18H13FN4/c1-11-7-12(4-5-15(11)19)18-14(3-2-6-20-18)13-8-16-17(21-9-13)10-22-23-16/h2-10H,1H3,(H,22,23)
InChIKeyHXXCUFZVFZBETC-UHFFFAOYSA-N
XLogP4.13
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.33
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine?
The IUPAC name of 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine (CID 90095810) is 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine.
What is the SMILES notation for 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine?
The canonical SMILES for 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine is Cc1cc(-c2ncccc2-c2cnc3cn[nH]c3c2)ccc1F.
What is the InChIKey of 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine?
The InChIKey is HXXCUFZVFZBETC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FN4/c1-11-7-12(4-5-15(11)19)18-14(3-2-6-20-18)13-8-16-17(21-9-13)10-22-23-16/h2-10H,1H3,(H,22,23).
What are the key properties of 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine?
6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine has a molecular weight of 304.33 g/mol, XLogP of 4.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1H-pyrazolo[4,5-b]pyridine is sourced from PubChem (CID 90095810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).