1-ethoxy-5-methoxypyridin-2-imine

C8H12N2O2 — CID 166786906

IUPAC1-ethoxy-5-methoxypyridin-2-imine
SMILES[H]/N=c1\ccc(OC)cn1OCC
InChIInChI=1S/C8H12N2O2/c1-3-12-10-6-7(11-2)4-5-8(10)9/h4-6,9H,3H2,1-2H3/b9-8+
InChIKeyQOMBGUAVFIUONY-CMDGGOBGSA-N
MW168.20 g/mol
LogP0.42
Rot. Bonds3

About 1-ethoxy-5-methoxypyridin-2-imine

1-ethoxy-5-methoxypyridin-2-imine (PubChem CID 166786906) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 1-ethoxy-5-methoxypyridin-2-imine.

Molecular Properties

Compound Name1-ethoxy-5-methoxypyridin-2-imine
PubChem CID166786906
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name1-ethoxy-5-methoxypyridin-2-imine
SMILES[H]/N=c1\ccc(OC)cn1OCC
InChIInChI=1S/C8H12N2O2/c1-3-12-10-6-7(11-2)4-5-8(10)9/h4-6,9H,3H2,1-2H3/b9-8+
InChIKeyQOMBGUAVFIUONY-CMDGGOBGSA-N
XLogP0.42
TPSA47.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-Ethyl-5-methoxypyridin-2-imine
CID 146663935
1-Ethoxy-6-iminopyridin-3-ol
CID 166786908
5-Methoxy-1-methylpyridin-2-imine
CID 166787051
Famotidine impurity 68
CID 131432575
1-Methanimidoyl-5-methoxypyridin-2-imine
CID 145588591

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-5-methoxypyridin-2-imine?
The IUPAC name of 1-ethoxy-5-methoxypyridin-2-imine (CID 166786906) is 1-ethoxy-5-methoxypyridin-2-imine.
What is the SMILES notation for 1-ethoxy-5-methoxypyridin-2-imine?
The canonical SMILES for 1-ethoxy-5-methoxypyridin-2-imine is [H]/N=c1\ccc(OC)cn1OCC.
What is the InChIKey of 1-ethoxy-5-methoxypyridin-2-imine?
The InChIKey is QOMBGUAVFIUONY-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-3-12-10-6-7(11-2)4-5-8(10)9/h4-6,9H,3H2,1-2H3/b9-8+.
What are the key properties of 1-ethoxy-5-methoxypyridin-2-imine?
1-ethoxy-5-methoxypyridin-2-imine has a molecular weight of 168.20 g/mol, XLogP of 0.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-5-methoxypyridin-2-imine is sourced from PubChem (CID 166786906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).