ethenamine;N-ethenyl-N-methylformamide

C6H12N2O — CID 87670470

IUPACethenamine;N-ethenyl-N-methylformamide
SMILESC=CN.C=CN(C)C=O
InChIInChI=1S/C4H7NO.C2H5N/c1-3-5(2)4-6;1-2-3/h3-4H,1H2,2H3;2H,1,3H2
InChIKeyIYBSMEZLGYOEDK-UHFFFAOYSA-N
MW128.17 g/mol
LogP0.31
Rot. Bonds2

About ethenamine;N-ethenyl-N-methylformamide

ethenamine;N-ethenyl-N-methylformamide (PubChem CID 87670470) has the molecular formula C6H12N2O and a molecular weight of 128.17 g/mol. Its IUPAC name is ethenamine;N-ethenyl-N-methylformamide.

Molecular Properties

Compound Nameethenamine;N-ethenyl-N-methylformamide
PubChem CID87670470
Molecular FormulaC6H12N2O
Molecular Weight128.17 g/mol
Exact Mass128.09
IUPAC Nameethenamine;N-ethenyl-N-methylformamide
SMILESC=CN.C=CN(C)C=O
InChIInChI=1S/C4H7NO.C2H5N/c1-3-5(2)4-6;1-2-3/h3-4H,1H2,2H3;2H,1,3H2
InChIKeyIYBSMEZLGYOEDK-UHFFFAOYSA-N
XLogP0.31
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethenamine;N-ethenylformamide
CID 87152102
ethenamine;N-ethenylformamide;hydrochloride
CID 170852785
N-ethenyl-N-ethylformamide
CID 13684986
1H-pyrazine-4-carbaldehyde
CID 18917932
Ethenyl-formyl-dimethylazanium
CID 19872355
N-[(Z)-2-formamidoethenyl]formamide
CID 59677980
N-(2-formamidoethenyl)formamide
CID 72355806
N-(1-aminoethenyl)-N-ethenylformamide
CID 87251546
CID 88460713
CID 88460713
N-[(E)-2-formamidoethenyl]formamide
CID 88740477
(Z)-N'-ethenyl-N'-(methoxymethyl)ethene-1,2-diamine
CID 88908797
N-[(Z)-2-(dimethylamino)ethenyl]-N-methylformamide
CID 89153598

Frequently Asked Questions

What is the IUPAC name of ethenamine;N-ethenyl-N-methylformamide?
The IUPAC name of ethenamine;N-ethenyl-N-methylformamide (CID 87670470) is ethenamine;N-ethenyl-N-methylformamide.
What is the SMILES notation for ethenamine;N-ethenyl-N-methylformamide?
The canonical SMILES for ethenamine;N-ethenyl-N-methylformamide is C=CN.C=CN(C)C=O.
What is the InChIKey of ethenamine;N-ethenyl-N-methylformamide?
The InChIKey is IYBSMEZLGYOEDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO.C2H5N/c1-3-5(2)4-6;1-2-3/h3-4H,1H2,2H3;2H,1,3H2.
What are the key properties of ethenamine;N-ethenyl-N-methylformamide?
ethenamine;N-ethenyl-N-methylformamide has a molecular weight of 128.17 g/mol, XLogP of 0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenamine;N-ethenyl-N-methylformamide is sourced from PubChem (CID 87670470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).