ethane;N-ethenyl-2-ethenylimino-N-methylethanamine

C9H18N2 — CID 143371078

IUPACethane;N-ethenyl-2-ethenylimino-N-methylethanamine
SMILESC=C/N=C/CN(C)C=C.CC
InChIInChI=1S/C7H12N2.C2H6/c1-4-8-6-7-9(3)5-2;1-2/h4-6H,1-2,7H2,3H3;1-2H3/b8-6+;
InChIKeyLMIAKIYRIHQCDY-WVLIHFOGSA-N
MW154.26 g/mol
LogP2.30
Rot. Bonds4

About ethane;N-ethenyl-2-ethenylimino-N-methylethanamine

ethane;N-ethenyl-2-ethenylimino-N-methylethanamine (PubChem CID 143371078) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is ethane;N-ethenyl-2-ethenylimino-N-methylethanamine.

Molecular Properties

Compound Nameethane;N-ethenyl-2-ethenylimino-N-methylethanamine
PubChem CID143371078
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Nameethane;N-ethenyl-2-ethenylimino-N-methylethanamine
SMILESC=C/N=C/CN(C)C=C.CC
InChIInChI=1S/C7H12N2.C2H6/c1-4-8-6-7-9(3)5-2;1-2/h4-6H,1-2,7H2,3H3;1-2H3/b8-6+;
InChIKeyLMIAKIYRIHQCDY-WVLIHFOGSA-N
XLogP2.30
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

Dihydromethylpyrazine
CID 21134130
N-ethylpyrazine
CID 90427580
Pyrazinium, 1,4-dimethyl-
CID 17841205
4-ethyl-1-methyl-2H-pyrazin-4-ium
CID 23148541
1,4-diethyl-2H-pyrazin-4-ium
CID 23148550
1,4-dipropyl-2H-pyrazin-4-ium
CID 23148557
4-ethyl-1-propyl-2H-pyrazin-4-ium
CID 23148560
4-methyl-1-propyl-2H-pyrazin-4-ium
CID 23148573
1,1,4-trimethyl-2H-pyrazine-1,4-diium
CID 54272638
1,1-diethyl-2H-pyrazin-1-ium
CID 57039441
3-[Ethenyl(ethylidene)azaniumyl]propyl-trimethylazanium
CID 59439858
3-[Ethenyl(ethylidene)azaniumyl]propyl-triethylazanium
CID 59439864

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethenyl-2-ethenylimino-N-methylethanamine?
The IUPAC name of ethane;N-ethenyl-2-ethenylimino-N-methylethanamine (CID 143371078) is ethane;N-ethenyl-2-ethenylimino-N-methylethanamine.
What is the SMILES notation for ethane;N-ethenyl-2-ethenylimino-N-methylethanamine?
The canonical SMILES for ethane;N-ethenyl-2-ethenylimino-N-methylethanamine is C=C/N=C/CN(C)C=C.CC.
What is the InChIKey of ethane;N-ethenyl-2-ethenylimino-N-methylethanamine?
The InChIKey is LMIAKIYRIHQCDY-WVLIHFOGSA-N. The full InChI is InChI=1S/C7H12N2.C2H6/c1-4-8-6-7-9(3)5-2;1-2/h4-6H,1-2,7H2,3H3;1-2H3/b8-6+;.
What are the key properties of ethane;N-ethenyl-2-ethenylimino-N-methylethanamine?
ethane;N-ethenyl-2-ethenylimino-N-methylethanamine has a molecular weight of 154.26 g/mol, XLogP of 2.30, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethenyl-2-ethenylimino-N-methylethanamine is sourced from PubChem (CID 143371078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).