6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one

C8H12N2O3 — CID 82442463

IUPAC6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one
SMILESCOCCn1nc(CO)ccc1=O
InChIInChI=1S/C8H12N2O3/c1-13-5-4-10-8(12)3-2-7(6-11)9-10/h2-3,11H,4-6H2,1H3
InChIKeyRMJGDMRFLVDFCK-UHFFFAOYSA-N
MW184.19 g/mol
LogP-0.62
Rot. Bonds4

About 6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one

6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one (PubChem CID 82442463) has the molecular formula C8H12N2O3 and a molecular weight of 184.19 g/mol. Its IUPAC name is 6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one.

Molecular Properties

Compound Name6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one
PubChem CID82442463
Molecular FormulaC8H12N2O3
Molecular Weight184.19 g/mol
Exact Mass184.08
IUPAC Name6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one
SMILESCOCCn1nc(CO)ccc1=O
InChIInChI=1S/C8H12N2O3/c1-13-5-4-10-8(12)3-2-7(6-11)9-10/h2-3,11H,4-6H2,1H3
InChIKeyRMJGDMRFLVDFCK-UHFFFAOYSA-N
XLogP-0.62
TPSA64.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 5-0.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-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

6-(Hydroxymethyl)-2-methyl-pyridazin-3-one
CID 52947892
N,N-diethyl-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 45797767
1-(2-Methoxyethyl)-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
CID 8899701
2-(3-Fluoro-2-hydroxypropyl)-6-methyl-2,3-dihydropyridazin-3-one
CID 165591202
1-(2-Methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 43091225
2-(2-Hydroxyethyl)-6-methyl-2,3-dihydropyridazin-3-one
CID 53991005
2-(2-Methoxyethyl)-6-methylpyridazin-3-one
CID 90691676
1,6-dihydro-1-(3-oxetanyl)-6-oxo-3-Pyridazinecarboxylic acid
CID 139512242
6-(Hydroxymethyl)-2-propan-2-ylpyridazin-3-one
CID 156372809
1-(2-Methoxyethyl)-6-oxopyridazine-3-carboxylate
CID 8899700
1-(2-Hydroxyethyl)-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
CID 28603375
N-(2-hydroxyethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 43392966

Frequently Asked Questions

What is the IUPAC name of 6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one?
The IUPAC name of 6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one (CID 82442463) is 6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one.
What is the SMILES notation for 6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one?
The canonical SMILES for 6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one is COCCn1nc(CO)ccc1=O.
What is the InChIKey of 6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one?
The InChIKey is RMJGDMRFLVDFCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3/c1-13-5-4-10-8(12)3-2-7(6-11)9-10/h2-3,11H,4-6H2,1H3.
What are the key properties of 6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one?
6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one has a molecular weight of 184.19 g/mol, XLogP of -0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(hydroxymethyl)-2-(2-methoxyethyl)pyridazin-3-one is sourced from PubChem (CID 82442463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).