N-[1-(methylideneamino)ethenyl]ethanimine

C5H8N2 — CID 90690774

IUPACN-[1-(methylideneamino)ethenyl]ethanimine
SMILESC=NC(=C)N=CC
InChIInChI=1S/C5H8N2/c1-4-7-5(2)6-3/h4H,2-3H2,1H3
InChIKeyWRHLYNBDGXORSO-UHFFFAOYSA-N
MW96.13 g/mol
LogP1.25
Rot. Bonds2

About N-[1-(methylideneamino)ethenyl]ethanimine

N-[1-(methylideneamino)ethenyl]ethanimine (PubChem CID 90690774) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol. Its IUPAC name is N-[1-(methylideneamino)ethenyl]ethanimine.

Molecular Properties

Compound NameN-[1-(methylideneamino)ethenyl]ethanimine
PubChem CID90690774
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC NameN-[1-(methylideneamino)ethenyl]ethanimine
SMILESC=NC(=C)N=CC
InChIInChI=1S/C5H8N2/c1-4-7-5(2)6-3/h4H,2-3H2,1H3
InChIKeyWRHLYNBDGXORSO-UHFFFAOYSA-N
XLogP1.25
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-Dimethylamino-2,5-diazafulvene
CID 10396839
Methylene-imidazole
CID 21951823
2-N'-ethylidene-1-N-methyl-2-N-methylideneethene-1,2,2-triimine
CID 53843184
N,N'-bis(ethenyl)ethane-1,2-diimine
CID 88267065
N-[(Z)-2-(ethylideneamino)ethenyl]ethanimine
CID 88583063
Ethane;2-methylideneimidazole
CID 90779285
N-[1-(methylideneamino)ethenyl]butan-1-imine
CID 90810945
N-[1-(methylideneamino)ethenyl]propan-1-imine
CID 91042440
N-[1-(methylideneamino)prop-1-enyl]ethanimine
CID 91297018
N'-ethenyl-N-methylethane-1,2-diimine
CID 91431711
N-[2-(ethylideneamino)ethenyl]ethanimine
CID 91519271
(Z)-N-ethenyl-N'-[(Z)-ethylideneamino]ethane-1,2-diimine
CID 123860666

Frequently Asked Questions

What is the IUPAC name of N-[1-(methylideneamino)ethenyl]ethanimine?
The IUPAC name of N-[1-(methylideneamino)ethenyl]ethanimine (CID 90690774) is N-[1-(methylideneamino)ethenyl]ethanimine.
What is the SMILES notation for N-[1-(methylideneamino)ethenyl]ethanimine?
The canonical SMILES for N-[1-(methylideneamino)ethenyl]ethanimine is C=NC(=C)N=CC.
What is the InChIKey of N-[1-(methylideneamino)ethenyl]ethanimine?
The InChIKey is WRHLYNBDGXORSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2/c1-4-7-5(2)6-3/h4H,2-3H2,1H3.
What are the key properties of N-[1-(methylideneamino)ethenyl]ethanimine?
N-[1-(methylideneamino)ethenyl]ethanimine has a molecular weight of 96.13 g/mol, XLogP of 1.25, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(methylideneamino)ethenyl]ethanimine is sourced from PubChem (CID 90690774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).