3-amino-1H-pyridazin-6-one;hydrochloride

C4H6ClN3O — CID 75419213

IUPAC3-amino-1H-pyridazin-6-one;hydrochloride
SMILESCl.Nc1ccc(=O)[nH]n1
InChIInChI=1S/C4H5N3O.ClH/c5-3-1-2-4(8)7-6-3;/h1-2H,(H2,5,6)(H,7,8);1H
InChIKeyBTFUJLRIPXNCNN-UHFFFAOYSA-N
MW147.57 g/mol
LogP-0.23
Rot. Bonds

About 3-amino-1H-pyridazin-6-one;hydrochloride

3-amino-1H-pyridazin-6-one;hydrochloride (PubChem CID 75419213) has the molecular formula C4H6ClN3O and a molecular weight of 147.57 g/mol. Its IUPAC name is 3-amino-1H-pyridazin-6-one;hydrochloride.

Molecular Properties

Compound Name3-amino-1H-pyridazin-6-one;hydrochloride
PubChem CID75419213
Molecular FormulaC4H6ClN3O
Molecular Weight147.57 g/mol
Exact Mass147.02
IUPAC Name3-amino-1H-pyridazin-6-one;hydrochloride
SMILESCl.Nc1ccc(=O)[nH]n1
InChIInChI=1S/C4H5N3O.ClH/c5-3-1-2-4(8)7-6-3;/h1-2H,(H2,5,6)(H,7,8);1H
InChIKeyBTFUJLRIPXNCNN-UHFFFAOYSA-N
XLogP-0.23
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.57
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-1H-pyridazin-6-one;hydrochloride 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 3-amino-1H-pyridazin-6-one;hydrochloride?
The IUPAC name of 3-amino-1H-pyridazin-6-one;hydrochloride (CID 75419213) is 3-amino-1H-pyridazin-6-one;hydrochloride.
What is the SMILES notation for 3-amino-1H-pyridazin-6-one;hydrochloride?
The canonical SMILES for 3-amino-1H-pyridazin-6-one;hydrochloride is Cl.Nc1ccc(=O)[nH]n1.
What is the InChIKey of 3-amino-1H-pyridazin-6-one;hydrochloride?
The InChIKey is BTFUJLRIPXNCNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N3O.ClH/c5-3-1-2-4(8)7-6-3;/h1-2H,(H2,5,6)(H,7,8);1H.
What are the key properties of 3-amino-1H-pyridazin-6-one;hydrochloride?
3-amino-1H-pyridazin-6-one;hydrochloride has a molecular weight of 147.57 g/mol, XLogP of -0.23, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1H-pyridazin-6-one;hydrochloride is sourced from PubChem (CID 75419213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).