N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine

C8H10N2 — CID 58797563

IUPACN-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine
SMILESC=CC1=CCNC=C1N=C
InChIInChI=1S/C8H10N2/c1-3-7-4-5-10-6-8(7)9-2/h3-4,6,10H,1-2,5H2
InChIKeyZSRCYHOQRYVFSE-UHFFFAOYSA-N
MW134.18 g/mol
LogP1.24
Rot. Bonds2

About N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine

N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine (PubChem CID 58797563) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine.

Molecular Properties

Compound NameN-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine
PubChem CID58797563
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC NameN-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine
SMILESC=CC1=CCNC=C1N=C
InChIInChI=1S/C8H10N2/c1-3-7-4-5-10-6-8(7)9-2/h3-4,6,10H,1-2,5H2
InChIKeyZSRCYHOQRYVFSE-UHFFFAOYSA-N
XLogP1.24
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.24
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-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine?
The IUPAC name of N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine (CID 58797563) is N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine.
What is the SMILES notation for N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine?
The canonical SMILES for N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine is C=CC1=CCNC=C1N=C.
What is the InChIKey of N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine?
The InChIKey is ZSRCYHOQRYVFSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-3-7-4-5-10-6-8(7)9-2/h3-4,6,10H,1-2,5H2.
What are the key properties of N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine?
N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine has a molecular weight of 134.18 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethenyl-1,2-dihydropyridin-5-yl)methanimine is sourced from PubChem (CID 58797563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).