6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one

C11H17N3O2 — CID 130348712

IUPAC6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one
SMILESCOC1CCN(c2ccc(=O)n(C)n2)CC1
InChIInChI=1S/C11H17N3O2/c1-13-11(15)4-3-10(12-13)14-7-5-9(16-2)6-8-14/h3-4,9H,5-8H2,1-2H3
InChIKeyGMNGFHGMMOQABT-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.40
Rot. Bonds2

About 6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one

6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one (PubChem CID 130348712) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one.

Molecular Properties

Compound Name6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one
PubChem CID130348712
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one
SMILESCOC1CCN(c2ccc(=O)n(C)n2)CC1
InChIInChI=1S/C11H17N3O2/c1-13-11(15)4-3-10(12-13)14-7-5-9(16-2)6-8-14/h3-4,9H,5-8H2,1-2H3
InChIKeyGMNGFHGMMOQABT-UHFFFAOYSA-N
XLogP0.40
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

Methyl 3-(6-oxo-3-piperidin-1-ylpyridazin-1-yl)propanoate
CID 59144402
2-Methyl-6-piperidin-1-ylpyridazin-3-one
CID 69406970
6-(4-hydroxypiperidin-1-yl)-2-methylpyridazin-3(2H)-one
CID 86721994
[1-(1-Methyl-6-oxopyridazin-3-yl)piperidin-4-yl] formate
CID 141386545
4-methoxy-N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide
CID 156375699
6-Piperidin-1-yl-2-prop-2-enylpyridazin-3-one
CID 156423933
2-Ethyl-6-piperidin-1-ylpyridazin-3-one
CID 167253237
6-(4-Methoxypiperidin-1-yl)pyridazin-3-ol
CID 121205975
[1-(6-oxo-1H-pyridazin-3-yl)piperidin-4-yl] acetate
CID 145702935

Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one?
The IUPAC name of 6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one (CID 130348712) is 6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one.
What is the SMILES notation for 6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one?
The canonical SMILES for 6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one is COC1CCN(c2ccc(=O)n(C)n2)CC1.
What is the InChIKey of 6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one?
The InChIKey is GMNGFHGMMOQABT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-13-11(15)4-3-10(12-13)14-7-5-9(16-2)6-8-14/h3-4,9H,5-8H2,1-2H3.
What are the key properties of 6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one?
6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one has a molecular weight of 223.28 g/mol, XLogP of 0.40, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxypiperidin-1-yl)-2-methylpyridazin-3-one is sourced from PubChem (CID 130348712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).