ethane;1-ethenylpyridin-2-imine

C11H20N2 — CID 145424502

IUPACethane;1-ethenylpyridin-2-imine
SMILESCC.CC.[H]/N=c1\ccccn1C=C
InChIInChI=1S/C7H8N2.2C2H6/c1-2-9-6-4-3-5-7(9)8;2*1-2/h2-6,8H,1H2;2*1-2H3/b8-7+;;
InChIKeyAFSXQTXFELLMPC-MIIBGCIDSA-N
MW180.29 g/mol
LogP3.12
Rot. Bonds1

About ethane;1-ethenylpyridin-2-imine

ethane;1-ethenylpyridin-2-imine (PubChem CID 145424502) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is ethane;1-ethenylpyridin-2-imine.

Molecular Properties

Compound Nameethane;1-ethenylpyridin-2-imine
PubChem CID145424502
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Nameethane;1-ethenylpyridin-2-imine
SMILESCC.CC.[H]/N=c1\ccccn1C=C
InChIInChI=1S/C7H8N2.2C2H6/c1-2-9-6-4-3-5-7(9)8;2*1-2/h2-6,8H,1H2;2*1-2H3/b8-7+;;
InChIKeyAFSXQTXFELLMPC-MIIBGCIDSA-N
XLogP3.12
TPSA28.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;1-ethenylpyridin-2-imine?
The IUPAC name of ethane;1-ethenylpyridin-2-imine (CID 145424502) is ethane;1-ethenylpyridin-2-imine.
What is the SMILES notation for ethane;1-ethenylpyridin-2-imine?
The canonical SMILES for ethane;1-ethenylpyridin-2-imine is CC.CC.[H]/N=c1\ccccn1C=C.
What is the InChIKey of ethane;1-ethenylpyridin-2-imine?
The InChIKey is AFSXQTXFELLMPC-MIIBGCIDSA-N. The full InChI is InChI=1S/C7H8N2.2C2H6/c1-2-9-6-4-3-5-7(9)8;2*1-2/h2-6,8H,1H2;2*1-2H3/b8-7+;;.
What are the key properties of ethane;1-ethenylpyridin-2-imine?
ethane;1-ethenylpyridin-2-imine has a molecular weight of 180.29 g/mol, XLogP of 3.12, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethenylpyridin-2-imine is sourced from PubChem (CID 145424502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).