3,5-dimethoxypyridin-4-amine

C7H10N2O2 — CID 45116644

IUPAC3,5-dimethoxypyridin-4-amine
SMILESCOc1cncc(OC)c1N
InChIInChI=1S/C7H10N2O2/c1-10-5-3-9-4-6(11-2)7(5)8/h3-4H,1-2H3,(H2,8,9)
InChIKeyWGTFHDOGITXBBS-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.68
Rot. Bonds2

About 3,5-dimethoxypyridin-4-amine

3,5-dimethoxypyridin-4-amine (PubChem CID 45116644) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 3,5-dimethoxypyridin-4-amine.

Molecular Properties

Compound Name3,5-dimethoxypyridin-4-amine
PubChem CID45116644
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name3,5-dimethoxypyridin-4-amine
SMILESCOc1cncc(OC)c1N
InChIInChI=1S/C7H10N2O2/c1-10-5-3-9-4-6(11-2)7(5)8/h3-4H,1-2H3,(H2,8,9)
InChIKeyWGTFHDOGITXBBS-UHFFFAOYSA-N
XLogP0.68
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxypyridin-4-amine?
The IUPAC name of 3,5-dimethoxypyridin-4-amine (CID 45116644) is 3,5-dimethoxypyridin-4-amine.
What is the SMILES notation for 3,5-dimethoxypyridin-4-amine?
The canonical SMILES for 3,5-dimethoxypyridin-4-amine is COc1cncc(OC)c1N.
What is the InChIKey of 3,5-dimethoxypyridin-4-amine?
The InChIKey is WGTFHDOGITXBBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-10-5-3-9-4-6(11-2)7(5)8/h3-4H,1-2H3,(H2,8,9).
What are the key properties of 3,5-dimethoxypyridin-4-amine?
3,5-dimethoxypyridin-4-amine has a molecular weight of 154.17 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxypyridin-4-amine is sourced from PubChem (CID 45116644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).