ethane;1-ethenylpyridin-2-imine;propane

C12H22N2 — CID 142516266

IUPACethane;1-ethenylpyridin-2-imine;propane
SMILESCC.CCC.[H]/N=c1\ccccn1C=C
InChIInChI=1S/C7H8N2.C3H8.C2H6/c1-2-9-6-4-3-5-7(9)8;1-3-2;1-2/h2-6,8H,1H2;3H2,1-2H3;1-2H3/b8-7+;;
InChIKeyHNEKUXWSCBIAKS-MIIBGCIDSA-N
MW194.32 g/mol
LogP3.51
Rot. Bonds1

About ethane;1-ethenylpyridin-2-imine;propane

ethane;1-ethenylpyridin-2-imine;propane (PubChem CID 142516266) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is ethane;1-ethenylpyridin-2-imine;propane.

Molecular Properties

Compound Nameethane;1-ethenylpyridin-2-imine;propane
PubChem CID142516266
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Nameethane;1-ethenylpyridin-2-imine;propane
SMILESCC.CCC.[H]/N=c1\ccccn1C=C
InChIInChI=1S/C7H8N2.C3H8.C2H6/c1-2-9-6-4-3-5-7(9)8;1-3-2;1-2/h2-6,8H,1H2;3H2,1-2H3;1-2H3/b8-7+;;
InChIKeyHNEKUXWSCBIAKS-MIIBGCIDSA-N
XLogP3.51
TPSA28.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 53.51
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;propane?
The IUPAC name of ethane;1-ethenylpyridin-2-imine;propane (CID 142516266) is ethane;1-ethenylpyridin-2-imine;propane.
What is the SMILES notation for ethane;1-ethenylpyridin-2-imine;propane?
The canonical SMILES for ethane;1-ethenylpyridin-2-imine;propane is CC.CCC.[H]/N=c1\ccccn1C=C.
What is the InChIKey of ethane;1-ethenylpyridin-2-imine;propane?
The InChIKey is HNEKUXWSCBIAKS-MIIBGCIDSA-N. The full InChI is InChI=1S/C7H8N2.C3H8.C2H6/c1-2-9-6-4-3-5-7(9)8;1-3-2;1-2/h2-6,8H,1H2;3H2,1-2H3;1-2H3/b8-7+;;.
What are the key properties of ethane;1-ethenylpyridin-2-imine;propane?
ethane;1-ethenylpyridin-2-imine;propane has a molecular weight of 194.32 g/mol, XLogP of 3.51, 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;propane is sourced from PubChem (CID 142516266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).