2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one

C11H17N3O2 — CID 114397069

IUPAC2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one
SMILESCN(C)c1cnn(CC(O)C2CC2)c(=O)c1
InChIInChI=1S/C11H17N3O2/c1-13(2)9-5-11(16)14(12-6-9)7-10(15)8-3-4-8/h5-6,8,10,15H,3-4,7H2,1-2H3
InChIKeyZPPOQXDFISDADA-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.08
Rot. Bonds4

About 2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one

2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one (PubChem CID 114397069) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one.

Molecular Properties

Compound Name2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one
PubChem CID114397069
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one
SMILESCN(C)c1cnn(CC(O)C2CC2)c(=O)c1
InChIInChI=1S/C11H17N3O2/c1-13(2)9-5-11(16)14(12-6-9)7-10(15)8-3-4-8/h5-6,8,10,15H,3-4,7H2,1-2H3
InChIKeyZPPOQXDFISDADA-UHFFFAOYSA-N
XLogP0.08
TPSA58.36 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 ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)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

5-(dimethylamino)-2-[(2S)-2-hydroxypropyl]pyridazin-3-one
CID 104920967
2-(2-cyclohexyl-2-hydroxyethyl)-5-(diethylamino)pyridazin-3-one
CID 114397134
2-(3-amino-2-hydroxypropyl)-5-(dimethylamino)pyridazin-3-one
CID 114395440
2-(3-chloro-2-methylpropyl)-5-(dimethylamino)pyridazin-3-one
CID 114394227
2-(2-cyclopentyl-2-hydroxyethyl)-5-pyrrolidin-1-ylpyridazin-3-one
CID 114397054
5-(dimethylamino)-2-(oxiran-2-ylmethyl)pyridazin-3-one
CID 114395499
5-(dimethylamino)-2-[3-(ethylamino)-2-methylpropyl]pyridazin-3-one
CID 114396794
5-(dimethylamino)-2-[2-(ethylamino)-3-methoxypropyl]pyridazin-3-one
CID 107506433
5-(dimethylamino)-2-[2-(methylaminomethyl)prop-2-enyl]pyridazin-3-one
CID 103073051
2-(3-aminopropyl)-5-(dimethylamino)pyridazin-3-one
CID 114393687
2-[2-amino-2-(3,4-dimethylphenyl)ethyl]-5-(dimethylamino)pyridazin-3-one
CID 114394568
5-(dimethylamino)-2-(2-piperidin-2-ylethyl)pyridazin-3-one
CID 114395884

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one?
The IUPAC name of 2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one (CID 114397069) is 2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one.
What is the SMILES notation for 2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one?
The canonical SMILES for 2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one is CN(C)c1cnn(CC(O)C2CC2)c(=O)c1.
What is the InChIKey of 2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one?
The InChIKey is ZPPOQXDFISDADA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-13(2)9-5-11(16)14(12-6-9)7-10(15)8-3-4-8/h5-6,8,10,15H,3-4,7H2,1-2H3.
What are the key properties of 2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one?
2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one has a molecular weight of 223.28 g/mol, XLogP of 0.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one is sourced from PubChem (CID 114397069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).