N-ethenyl-2-imino-N-methylethanamine

C5H10N2 — CID 90933998

IUPACN-ethenyl-2-imino-N-methylethanamine
SMILES[H]/N=C/CN(C)C=C
InChIInChI=1S/C5H10N2/c1-3-7(2)5-4-6/h3-4,6H,1,5H2,2H3/b6-4+
InChIKeyCVGXZWCZMGTVSY-GQCTYLIASA-N
MW98.15 g/mol
LogP0.71
Rot. Bonds3

About N-ethenyl-2-imino-N-methylethanamine

N-ethenyl-2-imino-N-methylethanamine (PubChem CID 90933998) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is N-ethenyl-2-imino-N-methylethanamine.

Molecular Properties

Compound NameN-ethenyl-2-imino-N-methylethanamine
PubChem CID90933998
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC NameN-ethenyl-2-imino-N-methylethanamine
SMILES[H]/N=C/CN(C)C=C
InChIInChI=1S/C5H10N2/c1-3-7(2)5-4-6/h3-4,6H,1,5H2,2H3/b6-4+
InChIKeyCVGXZWCZMGTVSY-GQCTYLIASA-N
XLogP0.71
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-2-imino-N-methylethanamine?
The IUPAC name of N-ethenyl-2-imino-N-methylethanamine (CID 90933998) is N-ethenyl-2-imino-N-methylethanamine.
What is the SMILES notation for N-ethenyl-2-imino-N-methylethanamine?
The canonical SMILES for N-ethenyl-2-imino-N-methylethanamine is [H]/N=C/CN(C)C=C.
What is the InChIKey of N-ethenyl-2-imino-N-methylethanamine?
The InChIKey is CVGXZWCZMGTVSY-GQCTYLIASA-N. The full InChI is InChI=1S/C5H10N2/c1-3-7(2)5-4-6/h3-4,6H,1,5H2,2H3/b6-4+.
What are the key properties of N-ethenyl-2-imino-N-methylethanamine?
N-ethenyl-2-imino-N-methylethanamine has a molecular weight of 98.15 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-2-imino-N-methylethanamine is sourced from PubChem (CID 90933998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).