N-ethenyl-1-[(Z)-propylideneamino]ethenamine

C7H12N2 — CID 89187994

IUPACN-ethenyl-1-[(Z)-propylideneamino]ethenamine
SMILESC=CNC(=C)/N=C\CC
InChIInChI=1S/C7H12N2/c1-4-6-9-7(3)8-5-2/h5-6,8H,2-4H2,1H3/b9-6-
InChIKeyOMEYQFHZPNHVGT-TWGQIWQCSA-N
MW124.19 g/mol
LogP1.67
Rot. Bonds4

About N-ethenyl-1-[(Z)-propylideneamino]ethenamine

N-ethenyl-1-[(Z)-propylideneamino]ethenamine (PubChem CID 89187994) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is N-ethenyl-1-[(Z)-propylideneamino]ethenamine.

Molecular Properties

Compound NameN-ethenyl-1-[(Z)-propylideneamino]ethenamine
PubChem CID89187994
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC NameN-ethenyl-1-[(Z)-propylideneamino]ethenamine
SMILESC=CNC(=C)/N=C\CC
InChIInChI=1S/C7H12N2/c1-4-6-9-7(3)8-5-2/h5-6,8H,2-4H2,1H3/b9-6-
InChIKeyOMEYQFHZPNHVGT-TWGQIWQCSA-N
XLogP1.67
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Methyldihydropyrazine
CID 21470001
2-Methylpyrazineamine
CID 129833553
ethane;2-methylidene-1H-pyrimidine
CID 90832574
(Z)-N-methyl-2-(propylideneamino)ethenamine
CID 118890765
2-[(Z)-2-aminoethenyl]imino-N-methylethanamine
CID 121451404
(Z)-2-(methylideneamino)-2-(propylideneamino)ethenamine
CID 123856235
(Z)-N-ethenyl-2-(ethylideneamino)ethenamine
CID 129144909
(E)-N-methyl-2-(1-methyliminopropan-2-ylideneamino)ethenamine
CID 137509817
(Z)-N-ethenyl-2-(2-methylpropylideneamino)ethenamine
CID 139316826
1-Ethenyl-3-propylideneurea
CID 141024424
N,2-dimethyl-1H-pyrazin-2-amine
CID 141268149
ethane;(Z)-2-(ethylideneamino)-N-methylethenamine
CID 141776765

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-1-[(Z)-propylideneamino]ethenamine?
The IUPAC name of N-ethenyl-1-[(Z)-propylideneamino]ethenamine (CID 89187994) is N-ethenyl-1-[(Z)-propylideneamino]ethenamine.
What is the SMILES notation for N-ethenyl-1-[(Z)-propylideneamino]ethenamine?
The canonical SMILES for N-ethenyl-1-[(Z)-propylideneamino]ethenamine is C=CNC(=C)/N=C\CC.
What is the InChIKey of N-ethenyl-1-[(Z)-propylideneamino]ethenamine?
The InChIKey is OMEYQFHZPNHVGT-TWGQIWQCSA-N. The full InChI is InChI=1S/C7H12N2/c1-4-6-9-7(3)8-5-2/h5-6,8H,2-4H2,1H3/b9-6-.
What are the key properties of N-ethenyl-1-[(Z)-propylideneamino]ethenamine?
N-ethenyl-1-[(Z)-propylideneamino]ethenamine has a molecular weight of 124.19 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-1-[(Z)-propylideneamino]ethenamine is sourced from PubChem (CID 89187994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).