2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one

C10H14N2O2 — CID 63906392

IUPAC2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one
SMILESCc1ccc(=O)n(CC(O)C2CC2)n1
InChIInChI=1S/C10H14N2O2/c1-7-2-5-10(14)12(11-7)6-9(13)8-3-4-8/h2,5,8-9,13H,3-4,6H2,1H3
InChIKeyRCWHMPRGXXTTNT-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.32
Rot. Bonds3

About 2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one

2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one (PubChem CID 63906392) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one.

Molecular Properties

Compound Name2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one
PubChem CID63906392
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one
SMILESCc1ccc(=O)n(CC(O)C2CC2)n1
InChIInChI=1S/C10H14N2O2/c1-7-2-5-10(14)12(11-7)6-9(13)8-3-4-8/h2,5,8-9,13H,3-4,6H2,1H3
InChIKeyRCWHMPRGXXTTNT-UHFFFAOYSA-N
XLogP0.32
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-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-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one?
The IUPAC name of 2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one (CID 63906392) is 2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one.
What is the SMILES notation for 2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one?
The canonical SMILES for 2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one is Cc1ccc(=O)n(CC(O)C2CC2)n1.
What is the InChIKey of 2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one?
The InChIKey is RCWHMPRGXXTTNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7-2-5-10(14)12(11-7)6-9(13)8-3-4-8/h2,5,8-9,13H,3-4,6H2,1H3.
What are the key properties of 2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one?
2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one has a molecular weight of 194.23 g/mol, XLogP of 0.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropyl-2-hydroxyethyl)-6-methylpyridazin-3-one is sourced from PubChem (CID 63906392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).