5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one

C11H19N3O3S — CID 106737001

IUPAC5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one
SMILESCCCS(=O)(=O)CCn1ncc(NCC)cc1=O
InChIInChI=1S/C11H19N3O3S/c1-3-6-18(16,17)7-5-14-11(15)8-10(9-13-14)12-4-2/h8-9,12H,3-7H2,1-2H3
InChIKeyHSBAHOVSYXCZOI-UHFFFAOYSA-N
MW273.36 g/mol
LogP0.50
Rot. Bonds7

About 5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one

5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one (PubChem CID 106737001) has the molecular formula C11H19N3O3S and a molecular weight of 273.36 g/mol. Its IUPAC name is 5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one.

Molecular Properties

Compound Name5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one
PubChem CID106737001
Molecular FormulaC11H19N3O3S
Molecular Weight273.36 g/mol
Exact Mass273.11
IUPAC Name5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one
SMILESCCCS(=O)(=O)CCn1ncc(NCC)cc1=O
InChIInChI=1S/C11H19N3O3S/c1-3-6-18(16,17)7-5-14-11(15)8-10(9-13-14)12-4-2/h8-9,12H,3-7H2,1-2H3
InChIKeyHSBAHOVSYXCZOI-UHFFFAOYSA-N
XLogP0.50
TPSA81.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-(ethylamino)-2-(2-propylsulfonylethyl)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

4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-1H-pyridazin-6-one
CID 102888056
5-Amino-2-(2-methylsulfonylethyl)pyridazin-3-one
CID 103218183
5-Amino-2-(2-ethylsulfanylethyl)pyridazin-3-one
CID 103218237
5-Amino-2-(3-ethylsulfonylpropyl)pyridazin-3-one
CID 103218262
5-Amino-2-(3-methylsulfanylpropyl)pyridazin-3-one
CID 103218308
5-Amino-2-(3-methylsulfonylpropyl)pyridazin-3-one
CID 103218404
5-Amino-2-(3-ethylsulfanylpropyl)pyridazin-3-one
CID 103218445
5-(Methylamino)-2-(2-methylsulfonylethyl)pyridazin-3-one
CID 103218462
5-(Methylamino)-2-(2-methylsulfanylethyl)pyridazin-3-one
CID 103218515
2-(2-Ethylsulfanylethyl)-5-(methylamino)pyridazin-3-one
CID 103218516
2-(3-Ethylsulfonylpropyl)-5-(methylamino)pyridazin-3-one
CID 103218544
5-(Methylamino)-2-(3-methylsulfanylpropyl)pyridazin-3-one
CID 103218592

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one?
The IUPAC name of 5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one (CID 106737001) is 5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one.
What is the SMILES notation for 5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one?
The canonical SMILES for 5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one is CCCS(=O)(=O)CCn1ncc(NCC)cc1=O.
What is the InChIKey of 5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one?
The InChIKey is HSBAHOVSYXCZOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3S/c1-3-6-18(16,17)7-5-14-11(15)8-10(9-13-14)12-4-2/h8-9,12H,3-7H2,1-2H3.
What are the key properties of 5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one?
5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one has a molecular weight of 273.36 g/mol, XLogP of 0.50, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-2-(2-propylsulfonylethyl)pyridazin-3-one is sourced from PubChem (CID 106737001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).