3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one

C11H9ClN2O2 — CID 106514741

IUPAC3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one
SMILESCOc1ccc(Cl)cc1-c1ccc(=O)[nH]n1
InChIInChI=1S/C11H9ClN2O2/c1-16-10-4-2-7(12)6-8(10)9-3-5-11(15)14-13-9/h2-6H,1H3,(H,14,15)
InChIKeyUVNAVSKTXVUIQK-UHFFFAOYSA-N
MW236.66 g/mol
LogP2.10
Rot. Bonds2

About 3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one

3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one (PubChem CID 106514741) has the molecular formula C11H9ClN2O2 and a molecular weight of 236.66 g/mol. Its IUPAC name is 3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one.

Molecular Properties

Compound Name3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one
PubChem CID106514741
Molecular FormulaC11H9ClN2O2
Molecular Weight236.66 g/mol
Exact Mass236.04
IUPAC Name3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one
SMILESCOc1ccc(Cl)cc1-c1ccc(=O)[nH]n1
InChIInChI=1S/C11H9ClN2O2/c1-16-10-4-2-7(12)6-8(10)9-3-5-11(15)14-13-9/h2-6H,1H3,(H,14,15)
InChIKeyUVNAVSKTXVUIQK-UHFFFAOYSA-N
XLogP2.10
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.66
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one with MolForge

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

Launch Full Analysis

Related Compounds

3-(5-chloro-2-methoxyphenyl)-5-(2-hydroxypropan-2-yl)-1H-pyridazin-6-one
CID 82446409
3-(5-chloro-2-methoxyphenyl)-1H-pyrazole-5-carboxylic acid
CID 3313057
3-(5-chloro-2-methoxyphenyl)-5-(sulfanylmethyl)-1H-pyridazin-6-one
CID 82446407
3-amino-6-(5-chloro-2-methoxyphenyl)-1H-pyridin-2-one
CID 82467202
6-(5-chloro-2-methoxyphenyl)-2-methyl-4-(sulfanylmethyl)pyridazin-3-one
CID 82444558
4-chloro-6-(5-chloro-2-methoxyphenyl)-2-propan-2-ylpyrimidine
CID 80952660
3-(4-chloro-2-methoxyphenyl)-1,4-dihydro-1,2,4-triazol-5-one
CID 136873215
4-(5-chloro-2-methoxyphenyl)-3H-1,3-thiazol-2-one
CID 82084785
4-(5-chloro-2-methoxyphenyl)-2-methoxypyrimidine
CID 116903740
2-[4-(5-chloro-2-methoxyphenyl)-1,3-thiazol-2-yl]acetaldehyde
CID 116968816
6-(5-chloro-2-methoxyphenyl)-5-fluoro-1H-pyrimidin-2-one
CID 106514718
2-[6-(5-chloro-2-methoxyphenyl)-2-methyl-3-pyridinyl]propan-2-ol
CID 82453379

Frequently Asked Questions

What is the IUPAC name of 3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one?
The IUPAC name of 3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one (CID 106514741) is 3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one.
What is the SMILES notation for 3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one?
The canonical SMILES for 3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one is COc1ccc(Cl)cc1-c1ccc(=O)[nH]n1.
What is the InChIKey of 3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one?
The InChIKey is UVNAVSKTXVUIQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O2/c1-16-10-4-2-7(12)6-8(10)9-3-5-11(15)14-13-9/h2-6H,1H3,(H,14,15).
What are the key properties of 3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one?
3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one has a molecular weight of 236.66 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chloro-2-methoxyphenyl)-1H-pyridazin-6-one is sourced from PubChem (CID 106514741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).