1-methoxypyridin-4-imine

C6H8N2O — CID 171384311

IUPAC1-methoxypyridin-4-imine
SMILES[H]N=c1ccn(OC)cc1
InChIInChI=1S/C6H8N2O/c1-9-8-4-2-6(7)3-5-8/h2-5,7H,1H3
InChIKeyLYOMYPMSLVXERB-UHFFFAOYSA-N
MW124.14 g/mol
LogP0.03
Rot. Bonds1

About 1-methoxypyridin-4-imine

1-methoxypyridin-4-imine (PubChem CID 171384311) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is 1-methoxypyridin-4-imine.

Molecular Properties

Compound Name1-methoxypyridin-4-imine
PubChem CID171384311
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC Name1-methoxypyridin-4-imine
SMILES[H]N=c1ccn(OC)cc1
InChIInChI=1S/C6H8N2O/c1-9-8-4-2-6(7)3-5-8/h2-5,7H,1H3
InChIKeyLYOMYPMSLVXERB-UHFFFAOYSA-N
XLogP0.03
TPSA38.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methoxypyridin-4-imine?
The IUPAC name of 1-methoxypyridin-4-imine (CID 171384311) is 1-methoxypyridin-4-imine.
What is the SMILES notation for 1-methoxypyridin-4-imine?
The canonical SMILES for 1-methoxypyridin-4-imine is [H]N=c1ccn(OC)cc1.
What is the InChIKey of 1-methoxypyridin-4-imine?
The InChIKey is LYOMYPMSLVXERB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c1-9-8-4-2-6(7)3-5-8/h2-5,7H,1H3.
What are the key properties of 1-methoxypyridin-4-imine?
1-methoxypyridin-4-imine has a molecular weight of 124.14 g/mol, XLogP of 0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxypyridin-4-imine is sourced from PubChem (CID 171384311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).