ethane;N-ethenyl-N-ethylethanimidamide

C8H18N2 — CID 142369051

IUPACethane;N-ethenyl-N-ethylethanimidamide
SMILESCC.[H]/N=C(\C)N(C=C)CC
InChIInChI=1S/C6H12N2.C2H6/c1-4-8(5-2)6(3)7;1-2/h4,7H,1,5H2,2-3H3;1-2H3/b7-6+;
InChIKeyQUYUFLVSLROVNV-UHDJGPCESA-N
MW142.25 g/mol
LogP2.48
Rot. Bonds2

About ethane;N-ethenyl-N-ethylethanimidamide

ethane;N-ethenyl-N-ethylethanimidamide (PubChem CID 142369051) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is ethane;N-ethenyl-N-ethylethanimidamide.

Molecular Properties

Compound Nameethane;N-ethenyl-N-ethylethanimidamide
PubChem CID142369051
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Nameethane;N-ethenyl-N-ethylethanimidamide
SMILESCC.[H]/N=C(\C)N(C=C)CC
InChIInChI=1S/C6H12N2.C2H6/c1-4-8(5-2)6(3)7;1-2/h4,7H,1,5H2,2-3H3;1-2H3/b7-6+;
InChIKeyQUYUFLVSLROVNV-UHDJGPCESA-N
XLogP2.48
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-ethenyl-N-propylpropanimidamide
CID 90299150
N-ethenyl-N-(2-methylbutyl)ethanimidamide
CID 118581484
N-ethenyl-N-methylethanimidamide
CID 123610848
N-ethenyl-N-ethylethanimidamide
CID 134603376
N-ethenyl-N-ethylpropanimidamide
CID 134603481
ethane;N-ethenyl-N-methylpropanimidamide;propane
CID 142516349
ethane;N-ethenyl-N-ethyl-N'-methylethanimidamide
CID 143939645
N-butyl-N-ethenylpropanimidamide;ethane;methane
CID 144672533
N-butyl-N-ethenylpropanimidamide;ethane
CID 145001599
N-ethenyl-N-propan-2-ylpropanimidamide
CID 146638834
1-(1-Ethylazirin-1-ium-1-yl)ethanimine
CID 147807396
N,N'-bis(ethenyl)-N-ethylethanimidamide;ethane
CID 153563551

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethenyl-N-ethylethanimidamide?
The IUPAC name of ethane;N-ethenyl-N-ethylethanimidamide (CID 142369051) is ethane;N-ethenyl-N-ethylethanimidamide.
What is the SMILES notation for ethane;N-ethenyl-N-ethylethanimidamide?
The canonical SMILES for ethane;N-ethenyl-N-ethylethanimidamide is CC.[H]/N=C(\C)N(C=C)CC.
What is the InChIKey of ethane;N-ethenyl-N-ethylethanimidamide?
The InChIKey is QUYUFLVSLROVNV-UHDJGPCESA-N. The full InChI is InChI=1S/C6H12N2.C2H6/c1-4-8(5-2)6(3)7;1-2/h4,7H,1,5H2,2-3H3;1-2H3/b7-6+;.
What are the key properties of ethane;N-ethenyl-N-ethylethanimidamide?
ethane;N-ethenyl-N-ethylethanimidamide has a molecular weight of 142.25 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethenyl-N-ethylethanimidamide is sourced from PubChem (CID 142369051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).