2-(2-hydroxyethyl)-6-methoxypyridazin-3-one

C7H10N2O3 — CID 105061940

IUPAC2-(2-hydroxyethyl)-6-methoxypyridazin-3-one
SMILESCOc1ccc(=O)n(CCO)n1
InChIInChI=1S/C7H10N2O3/c1-12-6-2-3-7(11)9(8-6)4-5-10/h2-3,10H,4-5H2,1H3
InChIKeyHRNXIRQOAPEKEQ-UHFFFAOYSA-N
MW170.17 g/mol
LogP-0.76
Rot. Bonds3

About 2-(2-hydroxyethyl)-6-methoxypyridazin-3-one

2-(2-hydroxyethyl)-6-methoxypyridazin-3-one (PubChem CID 105061940) has the molecular formula C7H10N2O3 and a molecular weight of 170.17 g/mol. Its IUPAC name is 2-(2-hydroxyethyl)-6-methoxypyridazin-3-one.

Molecular Properties

Compound Name2-(2-hydroxyethyl)-6-methoxypyridazin-3-one
PubChem CID105061940
Molecular FormulaC7H10N2O3
Molecular Weight170.17 g/mol
Exact Mass170.07
IUPAC Name2-(2-hydroxyethyl)-6-methoxypyridazin-3-one
SMILESCOc1ccc(=O)n(CCO)n1
InChIInChI=1S/C7H10N2O3/c1-12-6-2-3-7(11)9(8-6)4-5-10/h2-3,10H,4-5H2,1H3
InChIKeyHRNXIRQOAPEKEQ-UHFFFAOYSA-N
XLogP-0.76
TPSA64.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 5-0.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2-hydroxyethyl)-6-methoxypyridazin-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

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethyl)-6-methoxypyridazin-3-one?
The IUPAC name of 2-(2-hydroxyethyl)-6-methoxypyridazin-3-one (CID 105061940) is 2-(2-hydroxyethyl)-6-methoxypyridazin-3-one.
What is the SMILES notation for 2-(2-hydroxyethyl)-6-methoxypyridazin-3-one?
The canonical SMILES for 2-(2-hydroxyethyl)-6-methoxypyridazin-3-one is COc1ccc(=O)n(CCO)n1.
What is the InChIKey of 2-(2-hydroxyethyl)-6-methoxypyridazin-3-one?
The InChIKey is HRNXIRQOAPEKEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3/c1-12-6-2-3-7(11)9(8-6)4-5-10/h2-3,10H,4-5H2,1H3.
What are the key properties of 2-(2-hydroxyethyl)-6-methoxypyridazin-3-one?
2-(2-hydroxyethyl)-6-methoxypyridazin-3-one has a molecular weight of 170.17 g/mol, XLogP of -0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethyl)-6-methoxypyridazin-3-one is sourced from PubChem (CID 105061940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).