3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride

C9H8ClN3O — CID 126796349

IUPAC3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride
SMILESCl.O=c1ccc(-c2cccnc2)n[nH]1
InChIInChI=1S/C9H7N3O.ClH/c13-9-4-3-8(11-12-9)7-2-1-5-10-6-7;/h1-6H,(H,12,13);1H
InChIKeyDRXYPRVMTOPRIE-UHFFFAOYSA-N
MW209.64 g/mol
LogP1.25
Rot. Bonds1

About 3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride

3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride (PubChem CID 126796349) has the molecular formula C9H8ClN3O and a molecular weight of 209.64 g/mol. Its IUPAC name is 3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride.

Molecular Properties

Compound Name3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride
PubChem CID126796349
Molecular FormulaC9H8ClN3O
Molecular Weight209.64 g/mol
Exact Mass209.04
IUPAC Name3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride
SMILESCl.O=c1ccc(-c2cccnc2)n[nH]1
InChIInChI=1S/C9H7N3O.ClH/c13-9-4-3-8(11-12-9)7-2-1-5-10-6-7;/h1-6H,(H,12,13);1H
InChIKeyDRXYPRVMTOPRIE-UHFFFAOYSA-N
XLogP1.25
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.64
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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3-(pyridin-3-ylmethyl)-1H-pyridazin-6-one
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N-[4-[4-(6-oxo-1H-pyridazin-3-yl)phenyl]butyl]pyridine-3-carboxamide;hydrochloride
CID 18977165
3-phenyl-6-pyridin-3-ylpyridazine
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2,6-dipyridin-3-ylpyridine
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3-quinolin-6-yl-1H-pyridazin-6-one
CID 106519623
2-pyridin-3-ylpyridine;dihydrochloride
CID 67024611
bis(2-methylpropane);3-pyridin-3-ylpyridine
CID 158581875
5-pyridin-3-yl-1H-pyrimidine-2,4-dione;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride?
The IUPAC name of 3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride (CID 126796349) is 3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride.
What is the SMILES notation for 3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride?
The canonical SMILES for 3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride is Cl.O=c1ccc(-c2cccnc2)n[nH]1.
What is the InChIKey of 3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride?
The InChIKey is DRXYPRVMTOPRIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N3O.ClH/c13-9-4-3-8(11-12-9)7-2-1-5-10-6-7;/h1-6H,(H,12,13);1H.
What are the key properties of 3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride?
3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride has a molecular weight of 209.64 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride is sourced from PubChem (CID 126796349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).