1-(6-aminopyridazin-3-yl)ethenol

C6H7N3O — CID 118425956

IUPAC1-(6-aminopyridazin-3-yl)ethenol
SMILESC=C(O)c1ccc(N)nn1
InChIInChI=1S/C6H7N3O/c1-4(10)5-2-3-6(7)9-8-5/h2-3,10H,1H2,(H2,7,9)
InChIKeyWTVJUZLTTKVFJQ-UHFFFAOYSA-N
MW137.14 g/mol
LogP0.59
Rot. Bonds1

About 1-(6-aminopyridazin-3-yl)ethenol

1-(6-aminopyridazin-3-yl)ethenol (PubChem CID 118425956) has the molecular formula C6H7N3O and a molecular weight of 137.14 g/mol. Its IUPAC name is 1-(6-aminopyridazin-3-yl)ethenol.

Molecular Properties

Compound Name1-(6-aminopyridazin-3-yl)ethenol
PubChem CID118425956
Molecular FormulaC6H7N3O
Molecular Weight137.14 g/mol
Exact Mass137.06
IUPAC Name1-(6-aminopyridazin-3-yl)ethenol
SMILESC=C(O)c1ccc(N)nn1
InChIInChI=1S/C6H7N3O/c1-4(10)5-2-3-6(7)9-8-5/h2-3,10H,1H2,(H2,7,9)
InChIKeyWTVJUZLTTKVFJQ-UHFFFAOYSA-N
XLogP0.59
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.14
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

6-Aminopyridazine-3-carboxylic acid
CID 12200479
(6-Aminopyridazin-3-yl)methanol hydrochloride
CID 126797015
(6-Aminopyridazin-3-yl)methanol
CID 20557894
[6-Amino-4-(trifluoromethyl)pyridazin-3-yl]methanol
CID 170598629
N-[6-(1-hydroxyethyl)pyridazin-3-yl]methanesulfonamide
CID 71230505
6-(Methoxymethyl)pyridazin-3-amine
CID 117104924
2-(6-Aminopyridazin-3-yl)propan-2-ol
CID 118545170
6-(1-Ethoxyethenyl)pyridazin-3-amine
CID 165464344
2-(6-Amino-4-methylpyridazin-3-yl)propan-2-ol
CID 170631168
(5,6-Diaminopyridazin-3-yl)methanol
CID 117104927
(6-Amino-5-chloropyridazin-3-yl)methanol
CID 117104935
(6-Amino-5-bromopyridazin-3-yl)methanol
CID 117104943

Frequently Asked Questions

What is the IUPAC name of 1-(6-aminopyridazin-3-yl)ethenol?
The IUPAC name of 1-(6-aminopyridazin-3-yl)ethenol (CID 118425956) is 1-(6-aminopyridazin-3-yl)ethenol.
What is the SMILES notation for 1-(6-aminopyridazin-3-yl)ethenol?
The canonical SMILES for 1-(6-aminopyridazin-3-yl)ethenol is C=C(O)c1ccc(N)nn1.
What is the InChIKey of 1-(6-aminopyridazin-3-yl)ethenol?
The InChIKey is WTVJUZLTTKVFJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O/c1-4(10)5-2-3-6(7)9-8-5/h2-3,10H,1H2,(H2,7,9).
What are the key properties of 1-(6-aminopyridazin-3-yl)ethenol?
1-(6-aminopyridazin-3-yl)ethenol has a molecular weight of 137.14 g/mol, XLogP of 0.59, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-aminopyridazin-3-yl)ethenol is sourced from PubChem (CID 118425956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).