1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone

C10H8FN3O — CID 146592057

IUPAC1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone
SMILESCC(=O)c1ncc(F)cc1-n1cccn1
InChIInChI=1S/C10H8FN3O/c1-7(15)10-9(5-8(11)6-12-10)14-4-2-3-13-14/h2-6H,1H3
InChIKeyARDXGXHCSBACIJ-UHFFFAOYSA-N
MW205.19 g/mol
LogP1.61
Rot. Bonds2

About 1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone

1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone (PubChem CID 146592057) has the molecular formula C10H8FN3O and a molecular weight of 205.19 g/mol. Its IUPAC name is 1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone.

Molecular Properties

Compound Name1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone
PubChem CID146592057
Molecular FormulaC10H8FN3O
Molecular Weight205.19 g/mol
Exact Mass205.07
IUPAC Name1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone
SMILESCC(=O)c1ncc(F)cc1-n1cccn1
InChIInChI=1S/C10H8FN3O/c1-7(15)10-9(5-8(11)6-12-10)14-4-2-3-13-14/h2-6H,1H3
InChIKeyARDXGXHCSBACIJ-UHFFFAOYSA-N
XLogP1.61
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.19
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone?
The IUPAC name of 1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone (CID 146592057) is 1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone.
What is the SMILES notation for 1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone?
The canonical SMILES for 1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone is CC(=O)c1ncc(F)cc1-n1cccn1.
What is the InChIKey of 1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone?
The InChIKey is ARDXGXHCSBACIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3O/c1-7(15)10-9(5-8(11)6-12-10)14-4-2-3-13-14/h2-6H,1H3.
What are the key properties of 1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone?
1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone has a molecular weight of 205.19 g/mol, XLogP of 1.61, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-3-pyrazol-1-yl-2-pyridinyl)ethanone is sourced from PubChem (CID 146592057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).