4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline

C21H13FN4 — CID 69221833

IUPAC4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline
SMILESFc1cccc(-c2nn3ccccc3c2-c2ccnc3ccccc23)n1
InChIInChI=1S/C21H13FN4/c22-19-10-5-8-17(24-19)21-20(18-9-3-4-13-26(18)25-21)15-11-12-23-16-7-2-1-6-14(15)16/h1-13H
InChIKeyWMSQOJULFQLHPS-UHFFFAOYSA-N
MW340.36 g/mol
LogP4.75
Rot. Bonds2

About 4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline

4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline (PubChem CID 69221833) has the molecular formula C21H13FN4 and a molecular weight of 340.36 g/mol. Its IUPAC name is 4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline.

Molecular Properties

Compound Name4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline
PubChem CID69221833
Molecular FormulaC21H13FN4
Molecular Weight340.36 g/mol
Exact Mass340.11
IUPAC Name4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline
SMILESFc1cccc(-c2nn3ccccc3c2-c2ccnc3ccccc23)n1
InChIInChI=1S/C21H13FN4/c22-19-10-5-8-17(24-19)21-20(18-9-3-4-13-26(18)25-21)15-11-12-23-16-7-2-1-6-14(15)16/h1-13H
InChIKeyWMSQOJULFQLHPS-UHFFFAOYSA-N
XLogP4.75
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.36
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline?
The IUPAC name of 4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline (CID 69221833) is 4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline.
What is the SMILES notation for 4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline?
The canonical SMILES for 4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline is Fc1cccc(-c2nn3ccccc3c2-c2ccnc3ccccc23)n1.
What is the InChIKey of 4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline?
The InChIKey is WMSQOJULFQLHPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13FN4/c22-19-10-5-8-17(24-19)21-20(18-9-3-4-13-26(18)25-21)15-11-12-23-16-7-2-1-6-14(15)16/h1-13H.
What are the key properties of 4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline?
4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline has a molecular weight of 340.36 g/mol, XLogP of 4.75, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(6-fluoro-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]quinoline is sourced from PubChem (CID 69221833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).