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

C9H13N3 — CID 168898416

IUPACN-ethenyl-6-ethyl-2-methylpyridazin-3-imine
SMILESC=C/N=c1\ccc(CC)nn1C
InChIInChI=1S/C9H13N3/c1-4-8-6-7-9(10-5-2)12(3)11-8/h5-7H,2,4H2,1,3H3/b10-9+
InChIKeyQVJRALZKFUXQFC-MDZDMXLPSA-N
MW163.22 g/mol
LogP1.03
Rot. Bonds2

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

N-ethenyl-6-ethyl-2-methylpyridazin-3-imine (PubChem CID 168898416) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is N-ethenyl-6-ethyl-2-methylpyridazin-3-imine.

Molecular Properties

Compound NameN-ethenyl-6-ethyl-2-methylpyridazin-3-imine
PubChem CID168898416
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC NameN-ethenyl-6-ethyl-2-methylpyridazin-3-imine
SMILESC=C/N=c1\ccc(CC)nn1C
InChIInChI=1S/C9H13N3/c1-4-8-6-7-9(10-5-2)12(3)11-8/h5-7H,2,4H2,1,3H3/b10-9+
InChIKeyQVJRALZKFUXQFC-MDZDMXLPSA-N
XLogP1.03
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 ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-6-ethyl-2-methylpyridazin-3-imine?
The IUPAC name of N-ethenyl-6-ethyl-2-methylpyridazin-3-imine (CID 168898416) is N-ethenyl-6-ethyl-2-methylpyridazin-3-imine.
What is the SMILES notation for N-ethenyl-6-ethyl-2-methylpyridazin-3-imine?
The canonical SMILES for N-ethenyl-6-ethyl-2-methylpyridazin-3-imine is C=C/N=c1\ccc(CC)nn1C.
What is the InChIKey of N-ethenyl-6-ethyl-2-methylpyridazin-3-imine?
The InChIKey is QVJRALZKFUXQFC-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H13N3/c1-4-8-6-7-9(10-5-2)12(3)11-8/h5-7H,2,4H2,1,3H3/b10-9+.
What are the key properties of N-ethenyl-6-ethyl-2-methylpyridazin-3-imine?
N-ethenyl-6-ethyl-2-methylpyridazin-3-imine has a molecular weight of 163.22 g/mol, XLogP of 1.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-6-ethyl-2-methylpyridazin-3-imine is sourced from PubChem (CID 168898416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).