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

C11H19N3 — CID 168898415

IUPACethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine
SMILESC=C/N=c1\ccc(CC)nn1C.CC
InChIInChI=1S/C9H13N3.C2H6/c1-4-8-6-7-9(10-5-2)12(3)11-8;1-2/h5-7H,2,4H2,1,3H3;1-2H3/b10-9+;
InChIKeyDCCSIIIAEVLCRZ-RRABGKBLSA-N
MW193.29 g/mol
LogP2.05
Rot. Bonds2

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

ethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine (PubChem CID 168898415) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is ethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine.

Molecular Properties

Compound Nameethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine
PubChem CID168898415
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Nameethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine
SMILESC=C/N=c1\ccc(CC)nn1C.CC
InChIInChI=1S/C9H13N3.C2H6/c1-4-8-6-7-9(10-5-2)12(3)11-8;1-2/h5-7H,2,4H2,1,3H3;1-2H3/b10-9+;
InChIKeyDCCSIIIAEVLCRZ-RRABGKBLSA-N
XLogP2.05
TPSA30.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine?
The IUPAC name of ethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine (CID 168898415) is ethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine.
What is the SMILES notation for ethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine?
The canonical SMILES for ethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine is C=C/N=c1\ccc(CC)nn1C.CC.
What is the InChIKey of ethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine?
The InChIKey is DCCSIIIAEVLCRZ-RRABGKBLSA-N. The full InChI is InChI=1S/C9H13N3.C2H6/c1-4-8-6-7-9(10-5-2)12(3)11-8;1-2/h5-7H,2,4H2,1,3H3;1-2H3/b10-9+;.
What are the key properties of ethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine?
ethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine has a molecular weight of 193.29 g/mol, XLogP of 2.05, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethenyl-6-ethyl-2-methylpyridazin-3-imine is sourced from PubChem (CID 168898415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).