5-(4-methoxyphenoxy)-2-methylpyridazin-3-one

C12H12N2O3 — CID 10561535

IUPAC5-(4-methoxyphenoxy)-2-methylpyridazin-3-one
SMILESCOc1ccc(Oc2cnn(C)c(=O)c2)cc1
InChIInChI=1S/C12H12N2O3/c1-14-12(15)7-11(8-13-14)17-10-5-3-9(16-2)4-6-10/h3-8H,1-2H3
InChIKeyVUZULTDUNRYKQU-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.58
Rot. Bonds3

About 5-(4-methoxyphenoxy)-2-methylpyridazin-3-one

5-(4-methoxyphenoxy)-2-methylpyridazin-3-one (PubChem CID 10561535) has the molecular formula C12H12N2O3 and a molecular weight of 232.24 g/mol. Its IUPAC name is 5-(4-methoxyphenoxy)-2-methylpyridazin-3-one.

Molecular Properties

Compound Name5-(4-methoxyphenoxy)-2-methylpyridazin-3-one
PubChem CID10561535
Molecular FormulaC12H12N2O3
Molecular Weight232.24 g/mol
Exact Mass232.08
IUPAC Name5-(4-methoxyphenoxy)-2-methylpyridazin-3-one
SMILESCOc1ccc(Oc2cnn(C)c(=O)c2)cc1
InChIInChI=1S/C12H12N2O3/c1-14-12(15)7-11(8-13-14)17-10-5-3-9(16-2)4-6-10/h3-8H,1-2H3
InChIKeyVUZULTDUNRYKQU-UHFFFAOYSA-N
XLogP1.58
TPSA53.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-5-phenoxypyridazin-3-one
CID 10750618
7-methoxy-1-methylcinnolin-4-one
CID 89165041
5-(3,4-dipropylphenoxy)-2-methylpyridazin-3-one;methylcyclobutane
CID 143897180
(5R)-5-(4-methoxyphenyl)-1-methyl-5,6-dihydro-4H-pyrazolo[4,5-d]pyrimidin-7-one
CID 906702
4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide
CID 91924018
4-(4-methoxyphenoxy)-1-(3-methoxyphenyl)pyrazole
CID 117229524
3-[4-(4-methoxyphenoxy)pyrazol-1-yl]propan-1-amine
CID 115055561
5-[4-[2-hydroxy-2-(4-methoxyphenyl)acetyl]piperazin-1-yl]-2-methylpyridazin-3-one
CID 91776530
N-(4-methoxyphenyl)-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide
CID 53203894
N-(4-methoxyphenyl)-2-[4-(1-methyl-6-oxopyridazin-4-yl)piperazin-1-yl]acetamide
CID 171998493
1,3-bis(4-methoxyphenoxy)benzene
CID 629519
5-(4-methoxyphenyl)-1-methylpyrazol-4-amine
CID 28803590

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenoxy)-2-methylpyridazin-3-one?
The IUPAC name of 5-(4-methoxyphenoxy)-2-methylpyridazin-3-one (CID 10561535) is 5-(4-methoxyphenoxy)-2-methylpyridazin-3-one.
What is the SMILES notation for 5-(4-methoxyphenoxy)-2-methylpyridazin-3-one?
The canonical SMILES for 5-(4-methoxyphenoxy)-2-methylpyridazin-3-one is COc1ccc(Oc2cnn(C)c(=O)c2)cc1.
What is the InChIKey of 5-(4-methoxyphenoxy)-2-methylpyridazin-3-one?
The InChIKey is VUZULTDUNRYKQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3/c1-14-12(15)7-11(8-13-14)17-10-5-3-9(16-2)4-6-10/h3-8H,1-2H3.
What are the key properties of 5-(4-methoxyphenoxy)-2-methylpyridazin-3-one?
5-(4-methoxyphenoxy)-2-methylpyridazin-3-one has a molecular weight of 232.24 g/mol, XLogP of 1.58, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenoxy)-2-methylpyridazin-3-one is sourced from PubChem (CID 10561535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).