2-ethenyl-6-ethyl-N-methylpyridazin-3-imine

C9H13N3 — CID 170747578

IUPAC2-ethenyl-6-ethyl-N-methylpyridazin-3-imine
SMILESC=Cn1nc(CC)cc/c1=N\C
InChIInChI=1S/C9H13N3/c1-4-8-6-7-9(10-3)12(5-2)11-8/h5-7H,2,4H2,1,3H3/b10-9+
InChIKeyUITKKNWEVPJBFB-MDZDMXLPSA-N
MW163.22 g/mol
LogP1.08
Rot. Bonds2

About 2-ethenyl-6-ethyl-N-methylpyridazin-3-imine

2-ethenyl-6-ethyl-N-methylpyridazin-3-imine (PubChem CID 170747578) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is 2-ethenyl-6-ethyl-N-methylpyridazin-3-imine.

Molecular Properties

Compound Name2-ethenyl-6-ethyl-N-methylpyridazin-3-imine
PubChem CID170747578
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC Name2-ethenyl-6-ethyl-N-methylpyridazin-3-imine
SMILESC=Cn1nc(CC)cc/c1=N\C
InChIInChI=1S/C9H13N3/c1-4-8-6-7-9(10-3)12(5-2)11-8/h5-7H,2,4H2,1,3H3/b10-9+
InChIKeyUITKKNWEVPJBFB-MDZDMXLPSA-N
XLogP1.08
TPSA30.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-6-ethyl-N-methylpyridazin-3-imine?
The IUPAC name of 2-ethenyl-6-ethyl-N-methylpyridazin-3-imine (CID 170747578) is 2-ethenyl-6-ethyl-N-methylpyridazin-3-imine.
What is the SMILES notation for 2-ethenyl-6-ethyl-N-methylpyridazin-3-imine?
The canonical SMILES for 2-ethenyl-6-ethyl-N-methylpyridazin-3-imine is C=Cn1nc(CC)cc/c1=N\C.
What is the InChIKey of 2-ethenyl-6-ethyl-N-methylpyridazin-3-imine?
The InChIKey is UITKKNWEVPJBFB-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H13N3/c1-4-8-6-7-9(10-3)12(5-2)11-8/h5-7H,2,4H2,1,3H3/b10-9+.
What are the key properties of 2-ethenyl-6-ethyl-N-methylpyridazin-3-imine?
2-ethenyl-6-ethyl-N-methylpyridazin-3-imine has a molecular weight of 163.22 g/mol, XLogP of 1.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-6-ethyl-N-methylpyridazin-3-imine is sourced from PubChem (CID 170747578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).