5-chloro-4-(ethylamino)-1H-pyridazin-6-one

C6H8ClN3O — CID 10725893

IUPAC5-chloro-4-(ethylamino)-1H-pyridazin-6-one
SMILESCCNc1cn[nH]c(=O)c1Cl
InChIInChI=1S/C6H8ClN3O/c1-2-8-4-3-9-10-6(11)5(4)7/h3H,2H2,1H3,(H2,8,10,11)
InChIKeyPLYMEGHPXLNZKS-UHFFFAOYSA-N
MW173.60 g/mol
LogP0.86
Rot. Bonds2

About 5-chloro-4-(ethylamino)-1H-pyridazin-6-one

5-chloro-4-(ethylamino)-1H-pyridazin-6-one (PubChem CID 10725893) has the molecular formula C6H8ClN3O and a molecular weight of 173.60 g/mol. Its IUPAC name is 5-chloro-4-(ethylamino)-1H-pyridazin-6-one.

Molecular Properties

Compound Name5-chloro-4-(ethylamino)-1H-pyridazin-6-one
PubChem CID10725893
Molecular FormulaC6H8ClN3O
Molecular Weight173.60 g/mol
Exact Mass173.04
IUPAC Name5-chloro-4-(ethylamino)-1H-pyridazin-6-one
SMILESCCNc1cn[nH]c(=O)c1Cl
InChIInChI=1S/C6H8ClN3O/c1-2-8-4-3-9-10-6(11)5(4)7/h3H,2H2,1H3,(H2,8,10,11)
InChIKeyPLYMEGHPXLNZKS-UHFFFAOYSA-N
XLogP0.86
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.60
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-chloro-4-(ethylamino)-1H-pyridazin-6-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-chloro-4-(ethylamino)-1H-pyridazin-6-one?
The IUPAC name of 5-chloro-4-(ethylamino)-1H-pyridazin-6-one (CID 10725893) is 5-chloro-4-(ethylamino)-1H-pyridazin-6-one.
What is the SMILES notation for 5-chloro-4-(ethylamino)-1H-pyridazin-6-one?
The canonical SMILES for 5-chloro-4-(ethylamino)-1H-pyridazin-6-one is CCNc1cn[nH]c(=O)c1Cl.
What is the InChIKey of 5-chloro-4-(ethylamino)-1H-pyridazin-6-one?
The InChIKey is PLYMEGHPXLNZKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClN3O/c1-2-8-4-3-9-10-6(11)5(4)7/h3H,2H2,1H3,(H2,8,10,11).
What are the key properties of 5-chloro-4-(ethylamino)-1H-pyridazin-6-one?
5-chloro-4-(ethylamino)-1H-pyridazin-6-one has a molecular weight of 173.60 g/mol, XLogP of 0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-(ethylamino)-1H-pyridazin-6-one is sourced from PubChem (CID 10725893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).