6-(1-ethoxyethenyl)pyridazin-3-amine

C8H11N3O — CID 165464344

IUPAC6-(1-ethoxyethenyl)pyridazin-3-amine
SMILESC=C(OCC)c1ccc(N)nn1
InChIInChI=1S/C8H11N3O/c1-3-12-6(2)7-4-5-8(9)11-10-7/h4-5H,2-3H2,1H3,(H2,9,11)
InChIKeyZUWVTBZSDVCONS-UHFFFAOYSA-N
MW165.20 g/mol
LogP1.07
Rot. Bonds3

About 6-(1-ethoxyethenyl)pyridazin-3-amine

6-(1-ethoxyethenyl)pyridazin-3-amine (PubChem CID 165464344) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 6-(1-ethoxyethenyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(1-ethoxyethenyl)pyridazin-3-amine
PubChem CID165464344
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name6-(1-ethoxyethenyl)pyridazin-3-amine
SMILESC=C(OCC)c1ccc(N)nn1
InChIInChI=1S/C8H11N3O/c1-3-12-6(2)7-4-5-8(9)11-10-7/h4-5H,2-3H2,1H3,(H2,9,11)
InChIKeyZUWVTBZSDVCONS-UHFFFAOYSA-N
XLogP1.07
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 51.07
H-Bond Donors ≤ 51
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-Aminopyridazin-3-yl)methanol hydrochloride
CID 126797015
(6-Aminopyridazin-3-yl)methanol
CID 20557894
3-(1-Ethoxyethenyl)-6-(trifluoromethyl)pyridazine
CID 124107792
6-(2-Ethoxyethyl)pyridazin-3-amine
CID 68296159
3-(1-Butoxyethenyl)-6-methylpyridazine
CID 89562187
3-(1-Ethoxyethenyl)-6-methylpyridazine
CID 89608651
Ethane;ethyl 6-aminopyridazine-3-carboxylate
CID 91301674
6-(Methoxymethyl)pyridazin-3-amine
CID 117104924
6-(Oxolan-2-yl)pyridazin-3-amine
CID 117105675
1-(6-Aminopyridazin-3-yl)ethenol
CID 118425956
2-(6-Aminopyridazin-3-yl)propan-2-ol
CID 118545170
6-(2-Methyl-1,3-dioxolan-2-yl)pyridazin-3-amine
CID 168991888

Frequently Asked Questions

What is the IUPAC name of 6-(1-ethoxyethenyl)pyridazin-3-amine?
The IUPAC name of 6-(1-ethoxyethenyl)pyridazin-3-amine (CID 165464344) is 6-(1-ethoxyethenyl)pyridazin-3-amine.
What is the SMILES notation for 6-(1-ethoxyethenyl)pyridazin-3-amine?
The canonical SMILES for 6-(1-ethoxyethenyl)pyridazin-3-amine is C=C(OCC)c1ccc(N)nn1.
What is the InChIKey of 6-(1-ethoxyethenyl)pyridazin-3-amine?
The InChIKey is ZUWVTBZSDVCONS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-3-12-6(2)7-4-5-8(9)11-10-7/h4-5H,2-3H2,1H3,(H2,9,11).
What are the key properties of 6-(1-ethoxyethenyl)pyridazin-3-amine?
6-(1-ethoxyethenyl)pyridazin-3-amine has a molecular weight of 165.20 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-ethoxyethenyl)pyridazin-3-amine is sourced from PubChem (CID 165464344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).