5-bromo-2-methyl-3-propylpyridin-4-amine

C9H13BrN2 — CID 69238280

IUPAC5-bromo-2-methyl-3-propylpyridin-4-amine
SMILESCCCc1c(C)ncc(Br)c1N
InChIInChI=1S/C9H13BrN2/c1-3-4-7-6(2)12-5-8(10)9(7)11/h5H,3-4H2,1-2H3,(H2,11,12)
InChIKeyOYRQIJGQYYDUIR-UHFFFAOYSA-N
MW229.12 g/mol
LogP2.69
Rot. Bonds2

About 5-bromo-2-methyl-3-propylpyridin-4-amine

5-bromo-2-methyl-3-propylpyridin-4-amine (PubChem CID 69238280) has the molecular formula C9H13BrN2 and a molecular weight of 229.12 g/mol. Its IUPAC name is 5-bromo-2-methyl-3-propylpyridin-4-amine.

Molecular Properties

Compound Name5-bromo-2-methyl-3-propylpyridin-4-amine
PubChem CID69238280
Molecular FormulaC9H13BrN2
Molecular Weight229.12 g/mol
Exact Mass228.03
IUPAC Name5-bromo-2-methyl-3-propylpyridin-4-amine
SMILESCCCc1c(C)ncc(Br)c1N
InChIInChI=1S/C9H13BrN2/c1-3-4-7-6(2)12-5-8(10)9(7)11/h5H,3-4H2,1-2H3,(H2,11,12)
InChIKeyOYRQIJGQYYDUIR-UHFFFAOYSA-N
XLogP2.69
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.12
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-methyl-3-propylpyridin-4-amine?
The IUPAC name of 5-bromo-2-methyl-3-propylpyridin-4-amine (CID 69238280) is 5-bromo-2-methyl-3-propylpyridin-4-amine.
What is the SMILES notation for 5-bromo-2-methyl-3-propylpyridin-4-amine?
The canonical SMILES for 5-bromo-2-methyl-3-propylpyridin-4-amine is CCCc1c(C)ncc(Br)c1N.
What is the InChIKey of 5-bromo-2-methyl-3-propylpyridin-4-amine?
The InChIKey is OYRQIJGQYYDUIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13BrN2/c1-3-4-7-6(2)12-5-8(10)9(7)11/h5H,3-4H2,1-2H3,(H2,11,12).
What are the key properties of 5-bromo-2-methyl-3-propylpyridin-4-amine?
5-bromo-2-methyl-3-propylpyridin-4-amine has a molecular weight of 229.12 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-methyl-3-propylpyridin-4-amine is sourced from PubChem (CID 69238280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).