ethenamine;N-ethenylformamide;hydrochloride

C5H11ClN2O — CID 170852785

IUPACethenamine;N-ethenylformamide;hydrochloride
SMILESC=CN.C=CNC=O.Cl
InChIInChI=1S/C3H5NO.C2H5N.ClH/c1-2-4-3-5;1-2-3;/h2-3H,1H2,(H,4,5);2H,1,3H2;1H
InChIKeyMNIYCOSHEJBIHA-UHFFFAOYSA-N
MW150.61 g/mol
LogP0.39
Rot. Bonds2

About ethenamine;N-ethenylformamide;hydrochloride

ethenamine;N-ethenylformamide;hydrochloride (PubChem CID 170852785) has the molecular formula C5H11ClN2O and a molecular weight of 150.61 g/mol. Its IUPAC name is ethenamine;N-ethenylformamide;hydrochloride.

Molecular Properties

Compound Nameethenamine;N-ethenylformamide;hydrochloride
PubChem CID170852785
Molecular FormulaC5H11ClN2O
Molecular Weight150.61 g/mol
Exact Mass150.06
IUPAC Nameethenamine;N-ethenylformamide;hydrochloride
SMILESC=CN.C=CNC=O.Cl
InChIInChI=1S/C3H5NO.C2H5N.ClH/c1-2-4-3-5;1-2-3;/h2-3H,1H2,(H,4,5);2H,1,3H2;1H
InChIKeyMNIYCOSHEJBIHA-UHFFFAOYSA-N
XLogP0.39
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.61
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-Vinylformamide
CID 83191
ethenamine;N-ethenylformamide
CID 87152102
1H-pyrazine-4-carbaldehyde
CID 18917932
chloromethane;N-ethenylformamide
CID 22416281
N-[(Z)-2-formamidoethenyl]formamide
CID 59677980
N-(2-formamidoethenyl)formamide
CID 72355806
n-Vinylformamide potassium salt
CID 86609887
ethenamine;N-ethenyl-N-methylformamide
CID 87670470
CID 88460713
CID 88460713
N-ethenylformamide;hydrochloride
CID 88676818
N-[(E)-2-formamidoethenyl]formamide
CID 88740477
N-(1,2,2-trideuterioethenyl)formamide
CID 140630551

Frequently Asked Questions

What is the IUPAC name of ethenamine;N-ethenylformamide;hydrochloride?
The IUPAC name of ethenamine;N-ethenylformamide;hydrochloride (CID 170852785) is ethenamine;N-ethenylformamide;hydrochloride.
What is the SMILES notation for ethenamine;N-ethenylformamide;hydrochloride?
The canonical SMILES for ethenamine;N-ethenylformamide;hydrochloride is C=CN.C=CNC=O.Cl.
What is the InChIKey of ethenamine;N-ethenylformamide;hydrochloride?
The InChIKey is MNIYCOSHEJBIHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5NO.C2H5N.ClH/c1-2-4-3-5;1-2-3;/h2-3H,1H2,(H,4,5);2H,1,3H2;1H.
What are the key properties of ethenamine;N-ethenylformamide;hydrochloride?
ethenamine;N-ethenylformamide;hydrochloride has a molecular weight of 150.61 g/mol, XLogP of 0.39, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenamine;N-ethenylformamide;hydrochloride is sourced from PubChem (CID 170852785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).