5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one

C11H17N3O2 — CID 103219012

IUPAC5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one
SMILESCCNc1cnn(CC2CCCO2)c(=O)c1
InChIInChI=1S/C11H17N3O2/c1-2-12-9-6-11(15)14(13-7-9)8-10-4-3-5-16-10/h6-7,10,12H,2-5,8H2,1H3
InChIKeyGLSLVVPTQUOZEA-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.85
Rot. Bonds4

About 5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one

5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one (PubChem CID 103219012) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one.

Molecular Properties

Compound Name5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one
PubChem CID103219012
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one
SMILESCCNc1cnn(CC2CCCO2)c(=O)c1
InChIInChI=1S/C11H17N3O2/c1-2-12-9-6-11(15)14(13-7-9)8-10-4-3-5-16-10/h6-7,10,12H,2-5,8H2,1H3
InChIKeyGLSLVVPTQUOZEA-UHFFFAOYSA-N
XLogP0.85
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(ethylamino)-2-(oxolan-2-ylmethyl)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

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one?
The IUPAC name of 5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one (CID 103219012) is 5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one.
What is the SMILES notation for 5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one?
The canonical SMILES for 5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one is CCNc1cnn(CC2CCCO2)c(=O)c1.
What is the InChIKey of 5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one?
The InChIKey is GLSLVVPTQUOZEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-2-12-9-6-11(15)14(13-7-9)8-10-4-3-5-16-10/h6-7,10,12H,2-5,8H2,1H3.
What are the key properties of 5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one?
5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one has a molecular weight of 223.28 g/mol, XLogP of 0.85, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one is sourced from PubChem (CID 103219012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).