3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one

C9H6FN3O — CID 106515794

IUPAC3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one
SMILESO=c1ccc(-c2cncc(F)c2)n[nH]1
InChIInChI=1S/C9H6FN3O/c10-7-3-6(4-11-5-7)8-1-2-9(14)13-12-8/h1-5H,(H,13,14)
InChIKeyJEPNWPORXKXKSC-UHFFFAOYSA-N
MW191.16 g/mol
LogP0.97
Rot. Bonds1

About 3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one

3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one (PubChem CID 106515794) has the molecular formula C9H6FN3O and a molecular weight of 191.16 g/mol. Its IUPAC name is 3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one.

Molecular Properties

Compound Name3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one
PubChem CID106515794
Molecular FormulaC9H6FN3O
Molecular Weight191.16 g/mol
Exact Mass191.05
IUPAC Name3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one
SMILESO=c1ccc(-c2cncc(F)c2)n[nH]1
InChIInChI=1S/C9H6FN3O/c10-7-3-6(4-11-5-7)8-1-2-9(14)13-12-8/h1-5H,(H,13,14)
InChIKeyJEPNWPORXKXKSC-UHFFFAOYSA-N
XLogP0.97
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(5-methyl-3-pyridinyl)-1H-pyridazin-6-one
CID 20522388
3-(3-chloro-5-fluorophenyl)-1H-pyridazin-6-one
CID 106521121
3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride
CID 126796349
4-(5-fluoro-3-pyridinyl)-2-(trifluoromethyl)-1H-pyrimidin-6-one
CID 136802824
4-(5-fluoro-3-pyridinyl)-2-phenyl-1H-pyrimidin-6-one
CID 136692272
3-(5-fluoro-3-pyridinyl)-4,5-dimethyl-1H-pyridazin-6-one
CID 106515803
N-[6-(5-fluoro-3-pyridinyl)-3-pyridinyl]acetamide
CID 144972443
3-fluoro-N-[3-(6-oxo-1H-pyridazin-3-yl)phenyl]benzamide
CID 49035357
3-(5-methylthiophen-3-yl)-1H-pyridazin-6-one
CID 106518542
6-(5-fluoro-3-pyridinyl)-4-(trifluoromethyl)-1H-pyridin-2-one
CID 106515766
3-(1H-indol-5-yl)-1H-pyridazin-6-one
CID 170567503
3-(5-fluoro-3-pyridinyl)-4H-1,2,4-thiadiazol-5-one
CID 136639651

Frequently Asked Questions

What is the IUPAC name of 3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one?
The IUPAC name of 3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one (CID 106515794) is 3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one.
What is the SMILES notation for 3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one?
The canonical SMILES for 3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one is O=c1ccc(-c2cncc(F)c2)n[nH]1.
What is the InChIKey of 3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one?
The InChIKey is JEPNWPORXKXKSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6FN3O/c10-7-3-6(4-11-5-7)8-1-2-9(14)13-12-8/h1-5H,(H,13,14).
What are the key properties of 3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one?
3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one has a molecular weight of 191.16 g/mol, XLogP of 0.97, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-fluoro-3-pyridinyl)-1H-pyridazin-6-one is sourced from PubChem (CID 106515794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).