5-amino-3-methyl-1H-pyridazin-6-one;ethane

C7H13N3O — CID 142523889

IUPAC5-amino-3-methyl-1H-pyridazin-6-one;ethane
SMILESCC.Cc1cc(N)c(=O)[nH]n1
InChIInChI=1S/C5H7N3O.C2H6/c1-3-2-4(6)5(9)8-7-3;1-2/h2H,1H3,(H2,6,7)(H,8,9);1-2H3
InChIKeyONQUCRPQUDWAJV-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.69
Rot. Bonds

About 5-amino-3-methyl-1H-pyridazin-6-one;ethane

5-amino-3-methyl-1H-pyridazin-6-one;ethane (PubChem CID 142523889) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 5-amino-3-methyl-1H-pyridazin-6-one;ethane.

Molecular Properties

Compound Name5-amino-3-methyl-1H-pyridazin-6-one;ethane
PubChem CID142523889
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name5-amino-3-methyl-1H-pyridazin-6-one;ethane
SMILESCC.Cc1cc(N)c(=O)[nH]n1
InChIInChI=1S/C5H7N3O.C2H6/c1-3-2-4(6)5(9)8-7-3;1-2/h2H,1H3,(H2,6,7)(H,8,9);1-2H3
InChIKeyONQUCRPQUDWAJV-UHFFFAOYSA-N
XLogP0.69
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-amino-3-methyl-1H-pyridazin-6-one;ethane 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-amino-3-methyl-1H-pyridazin-6-one;ethane?
The IUPAC name of 5-amino-3-methyl-1H-pyridazin-6-one;ethane (CID 142523889) is 5-amino-3-methyl-1H-pyridazin-6-one;ethane.
What is the SMILES notation for 5-amino-3-methyl-1H-pyridazin-6-one;ethane?
The canonical SMILES for 5-amino-3-methyl-1H-pyridazin-6-one;ethane is CC.Cc1cc(N)c(=O)[nH]n1.
What is the InChIKey of 5-amino-3-methyl-1H-pyridazin-6-one;ethane?
The InChIKey is ONQUCRPQUDWAJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O.C2H6/c1-3-2-4(6)5(9)8-7-3;1-2/h2H,1H3,(H2,6,7)(H,8,9);1-2H3.
What are the key properties of 5-amino-3-methyl-1H-pyridazin-6-one;ethane?
5-amino-3-methyl-1H-pyridazin-6-one;ethane has a molecular weight of 155.20 g/mol, XLogP of 0.69, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-methyl-1H-pyridazin-6-one;ethane is sourced from PubChem (CID 142523889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).