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

C14H10FN3O — CID 18446593

IUPAC1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone
SMILESCC(=O)c1nn2ccccc2c1-c1ccnc(F)c1
InChIInChI=1S/C14H10FN3O/c1-9(19)14-13(10-5-6-16-12(15)8-10)11-4-2-3-7-18(11)17-14/h2-8H,1H3
InChIKeyBUXKDXNOHQFFLM-UHFFFAOYSA-N
MW255.25 g/mol
LogP2.74
Rot. Bonds2

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

1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone (PubChem CID 18446593) has the molecular formula C14H10FN3O and a molecular weight of 255.25 g/mol. Its IUPAC name is 1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone.

Molecular Properties

Compound Name1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone
PubChem CID18446593
Molecular FormulaC14H10FN3O
Molecular Weight255.25 g/mol
Exact Mass255.08
IUPAC Name1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone
SMILESCC(=O)c1nn2ccccc2c1-c1ccnc(F)c1
InChIInChI=1S/C14H10FN3O/c1-9(19)14-13(10-5-6-16-12(15)8-10)11-4-2-3-7-18(11)17-14/h2-8H,1H3
InChIKeyBUXKDXNOHQFFLM-UHFFFAOYSA-N
XLogP2.74
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.25
LogP ≤ 52.74
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 1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone?
The IUPAC name of 1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone (CID 18446593) is 1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone.
What is the SMILES notation for 1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone?
The canonical SMILES for 1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone is CC(=O)c1nn2ccccc2c1-c1ccnc(F)c1.
What is the InChIKey of 1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone?
The InChIKey is BUXKDXNOHQFFLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O/c1-9(19)14-13(10-5-6-16-12(15)8-10)11-4-2-3-7-18(11)17-14/h2-8H,1H3.
What are the key properties of 1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone?
1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone has a molecular weight of 255.25 g/mol, XLogP of 2.74, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-2-yl]ethanone is sourced from PubChem (CID 18446593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).