3-bromo-5-methoxy-6-methylpyridin-2-amine

C7H9BrN2O — CID 130133402

IUPAC3-bromo-5-methoxy-6-methylpyridin-2-amine
SMILESCOc1cc(Br)c(N)nc1C
InChIInChI=1S/C7H9BrN2O/c1-4-6(11-2)3-5(8)7(9)10-4/h3H,1-2H3,(H2,9,10)
InChIKeyZJEXUIGQZGWJPL-UHFFFAOYSA-N
MW217.07 g/mol
LogP1.74
Rot. Bonds1

About 3-bromo-5-methoxy-6-methylpyridin-2-amine

3-bromo-5-methoxy-6-methylpyridin-2-amine (PubChem CID 130133402) has the molecular formula C7H9BrN2O and a molecular weight of 217.07 g/mol. Its IUPAC name is 3-bromo-5-methoxy-6-methylpyridin-2-amine.

Molecular Properties

Compound Name3-bromo-5-methoxy-6-methylpyridin-2-amine
PubChem CID130133402
Molecular FormulaC7H9BrN2O
Molecular Weight217.07 g/mol
Exact Mass215.99
IUPAC Name3-bromo-5-methoxy-6-methylpyridin-2-amine
SMILESCOc1cc(Br)c(N)nc1C
InChIInChI=1S/C7H9BrN2O/c1-4-6(11-2)3-5(8)7(9)10-4/h3H,1-2H3,(H2,9,10)
InChIKeyZJEXUIGQZGWJPL-UHFFFAOYSA-N
XLogP1.74
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.07
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-methoxy-6-methylpyridin-2-amine?
The IUPAC name of 3-bromo-5-methoxy-6-methylpyridin-2-amine (CID 130133402) is 3-bromo-5-methoxy-6-methylpyridin-2-amine.
What is the SMILES notation for 3-bromo-5-methoxy-6-methylpyridin-2-amine?
The canonical SMILES for 3-bromo-5-methoxy-6-methylpyridin-2-amine is COc1cc(Br)c(N)nc1C.
What is the InChIKey of 3-bromo-5-methoxy-6-methylpyridin-2-amine?
The InChIKey is ZJEXUIGQZGWJPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrN2O/c1-4-6(11-2)3-5(8)7(9)10-4/h3H,1-2H3,(H2,9,10).
What are the key properties of 3-bromo-5-methoxy-6-methylpyridin-2-amine?
3-bromo-5-methoxy-6-methylpyridin-2-amine has a molecular weight of 217.07 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-methoxy-6-methylpyridin-2-amine is sourced from PubChem (CID 130133402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).