2-(ethylideneamino)ethenyl-methylidyneazanium

C5H7N2+ — CID 90970786

IUPAC2-(ethylideneamino)ethenyl-methylidyneazanium
SMILESC#[N+]C=C/N=C/C
InChIInChI=1S/C5H7N2/c1-3-7-5-4-6-2/h2-5H,1H3/q+1/b5-4?,7-3+
InChIKeyVMAVGSFGFZBRBY-WEJKQIJESA-N
MW95.12 g/mol
LogP1.51
Rot. Bonds1

About 2-(ethylideneamino)ethenyl-methylidyneazanium

2-(ethylideneamino)ethenyl-methylidyneazanium (PubChem CID 90970786) has the molecular formula C5H7N2+ and a molecular weight of 95.12 g/mol. Its IUPAC name is 2-(ethylideneamino)ethenyl-methylidyneazanium.

Molecular Properties

Compound Name2-(ethylideneamino)ethenyl-methylidyneazanium
PubChem CID90970786
Molecular FormulaC5H7N2+
Molecular Weight95.12 g/mol
Exact Mass95.06
IUPAC Name2-(ethylideneamino)ethenyl-methylidyneazanium
SMILESC#[N+]C=C/N=C/C
InChIInChI=1S/C5H7N2/c1-3-7-5-4-6-2/h2-5H,1H3/q+1/b5-4?,7-3+
InChIKeyVMAVGSFGFZBRBY-WEJKQIJESA-N
XLogP1.51
TPSA16.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50095.12
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(1E)-N-Ethenylethanimine
CID 13099158
1,4-Diazahexatriene
CID 60012500
2H-pyrazin-2-ide
CID 122209652
N-[(E)-2-fluoro-2-(methylideneamino)ethenyl]ethanimine
CID 146223247
carbanide;2H-pyrazin-2-ide;yttrium
CID 58939202
Carbanide;2,5-dihydropyrazine-2,5-diide;bis(yttrium)
CID 58939220
ethane;2H-pyrazin-2-ide;tungsten(2+)
CID 60069529
N,N'-bis(ethenyl)ethane-1,2-diimine
CID 88267065
(Z)-2-(ethylideneamino)-N,N-dimethylethenamine
CID 88529839
N-[(Z)-2-(ethylideneamino)ethenyl]ethanimine
CID 88583063
N'-ethenyl-N-methylethane-1,2-diimine
CID 91431711
N-[2-(ethylideneamino)ethenyl]ethanimine
CID 91519271

Frequently Asked Questions

What is the IUPAC name of 2-(ethylideneamino)ethenyl-methylidyneazanium?
The IUPAC name of 2-(ethylideneamino)ethenyl-methylidyneazanium (CID 90970786) is 2-(ethylideneamino)ethenyl-methylidyneazanium.
What is the SMILES notation for 2-(ethylideneamino)ethenyl-methylidyneazanium?
The canonical SMILES for 2-(ethylideneamino)ethenyl-methylidyneazanium is C#[N+]C=C/N=C/C.
What is the InChIKey of 2-(ethylideneamino)ethenyl-methylidyneazanium?
The InChIKey is VMAVGSFGFZBRBY-WEJKQIJESA-N. The full InChI is InChI=1S/C5H7N2/c1-3-7-5-4-6-2/h2-5H,1H3/q+1/b5-4?,7-3+.
What are the key properties of 2-(ethylideneamino)ethenyl-methylidyneazanium?
2-(ethylideneamino)ethenyl-methylidyneazanium has a molecular weight of 95.12 g/mol, XLogP of 1.51, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylideneamino)ethenyl-methylidyneazanium is sourced from PubChem (CID 90970786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).