N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine

C9H10N2 — CID 166455325

IUPACN-(4-ethenyl-5-methyl-3-pyridinyl)methanimine
SMILESC=Cc1c(C)cncc1N=C
InChIInChI=1S/C9H10N2/c1-4-8-7(2)5-11-6-9(8)10-3/h4-6H,1,3H2,2H3
InChIKeyWGGWGEPXJWAXOX-UHFFFAOYSA-N
MW146.19 g/mol
LogP2.37
Rot. Bonds2

About N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine

N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine (PubChem CID 166455325) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine.

Molecular Properties

Compound NameN-(4-ethenyl-5-methyl-3-pyridinyl)methanimine
PubChem CID166455325
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC NameN-(4-ethenyl-5-methyl-3-pyridinyl)methanimine
SMILESC=Cc1c(C)cncc1N=C
InChIInChI=1S/C9H10N2/c1-4-8-7(2)5-11-6-9(8)10-3/h4-6H,1,3H2,2H3
InChIKeyWGGWGEPXJWAXOX-UHFFFAOYSA-N
XLogP2.37
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 52.37
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-(4-ethenyl-5-methyl-3-pyridinyl)methanimine?
The IUPAC name of N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine (CID 166455325) is N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine.
What is the SMILES notation for N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine?
The canonical SMILES for N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine is C=Cc1c(C)cncc1N=C.
What is the InChIKey of N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine?
The InChIKey is WGGWGEPXJWAXOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-4-8-7(2)5-11-6-9(8)10-3/h4-6H,1,3H2,2H3.
What are the key properties of N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine?
N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine has a molecular weight of 146.19 g/mol, XLogP of 2.37, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethenyl-5-methyl-3-pyridinyl)methanimine is sourced from PubChem (CID 166455325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).