N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine

C8H10N2 — CID 143157755

IUPACN-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine
SMILESC=NC(=C)C1=NC=CCC1
InChIInChI=1S/C8H10N2/c1-7(9-2)8-5-3-4-6-10-8/h4,6H,1-3,5H2
InChIKeyZAESZUKTDZVJRG-UHFFFAOYSA-N
MW134.18 g/mol
LogP1.95
Rot. Bonds2

About N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine

N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine (PubChem CID 143157755) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine.

Molecular Properties

Compound NameN-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine
PubChem CID143157755
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC NameN-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine
SMILESC=NC(=C)C1=NC=CCC1
InChIInChI=1S/C8H10N2/c1-7(9-2)8-5-3-4-6-10-8/h4,6H,1-3,5H2
InChIKeyZAESZUKTDZVJRG-UHFFFAOYSA-N
XLogP1.95
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.95
H-Bond Donors ≤ 50
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-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine?
The IUPAC name of N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine (CID 143157755) is N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine.
What is the SMILES notation for N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine?
The canonical SMILES for N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine is C=NC(=C)C1=NC=CCC1.
What is the InChIKey of N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine?
The InChIKey is ZAESZUKTDZVJRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-7(9-2)8-5-3-4-6-10-8/h4,6H,1-3,5H2.
What are the key properties of N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine?
N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine has a molecular weight of 134.18 g/mol, XLogP of 1.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,4-dihydropyridin-2-yl)ethenyl]methanimine is sourced from PubChem (CID 143157755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).