1-ethenyl-4-methoxy-N-methylpyridin-2-imine

C9H12N2O — CID 143234561

IUPAC1-ethenyl-4-methoxy-N-methylpyridin-2-imine
SMILESC=Cn1ccc(OC)c/c1=N\C
InChIInChI=1S/C9H12N2O/c1-4-11-6-5-8(12-3)7-9(11)10-2/h4-7H,1H2,2-3H3/b10-9+
InChIKeyPLUDSUYRCYTKPZ-MDZDMXLPSA-N
MW164.21 g/mol
LogP1.13
Rot. Bonds2

About 1-ethenyl-4-methoxy-N-methylpyridin-2-imine

1-ethenyl-4-methoxy-N-methylpyridin-2-imine (PubChem CID 143234561) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 1-ethenyl-4-methoxy-N-methylpyridin-2-imine.

Molecular Properties

Compound Name1-ethenyl-4-methoxy-N-methylpyridin-2-imine
PubChem CID143234561
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name1-ethenyl-4-methoxy-N-methylpyridin-2-imine
SMILESC=Cn1ccc(OC)c/c1=N\C
InChIInChI=1S/C9H12N2O/c1-4-11-6-5-8(12-3)7-9(11)10-2/h4-7H,1H2,2-3H3/b10-9+
InChIKeyPLUDSUYRCYTKPZ-MDZDMXLPSA-N
XLogP1.13
TPSA26.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4-methoxy-N-methylpyridin-2-imine?
The IUPAC name of 1-ethenyl-4-methoxy-N-methylpyridin-2-imine (CID 143234561) is 1-ethenyl-4-methoxy-N-methylpyridin-2-imine.
What is the SMILES notation for 1-ethenyl-4-methoxy-N-methylpyridin-2-imine?
The canonical SMILES for 1-ethenyl-4-methoxy-N-methylpyridin-2-imine is C=Cn1ccc(OC)c/c1=N\C.
What is the InChIKey of 1-ethenyl-4-methoxy-N-methylpyridin-2-imine?
The InChIKey is PLUDSUYRCYTKPZ-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H12N2O/c1-4-11-6-5-8(12-3)7-9(11)10-2/h4-7H,1H2,2-3H3/b10-9+.
What are the key properties of 1-ethenyl-4-methoxy-N-methylpyridin-2-imine?
1-ethenyl-4-methoxy-N-methylpyridin-2-imine has a molecular weight of 164.21 g/mol, XLogP of 1.13, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-methoxy-N-methylpyridin-2-imine is sourced from PubChem (CID 143234561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).