5-bromo-N-ethylpyridin-2-amine

C7H9BrN2 — CID 22504916

IUPAC5-bromo-N-ethylpyridin-2-amine
SMILESCCNc1ccc(Br)cn1
InChIInChI=1S/C7H9BrN2/c1-2-9-7-4-3-6(8)5-10-7/h3-5H,2H2,1H3,(H,9,10)
InChIKeyPTXWZJGCLYCDFV-UHFFFAOYSA-N
MW201.07 g/mol
LogP2.28
Rot. Bonds2

About 5-bromo-N-ethylpyridin-2-amine

5-bromo-N-ethylpyridin-2-amine (PubChem CID 22504916) has the molecular formula C7H9BrN2 and a molecular weight of 201.07 g/mol. Its IUPAC name is 5-bromo-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-ethylpyridin-2-amine
PubChem CID22504916
Molecular FormulaC7H9BrN2
Molecular Weight201.07 g/mol
Exact Mass199.99
IUPAC Name5-bromo-N-ethylpyridin-2-amine
SMILESCCNc1ccc(Br)cn1
InChIInChI=1S/C7H9BrN2/c1-2-9-7-4-3-6(8)5-10-7/h3-5H,2H2,1H3,(H,9,10)
InChIKeyPTXWZJGCLYCDFV-UHFFFAOYSA-N
XLogP2.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.07
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-ethylpyridin-2-amine?
The IUPAC name of 5-bromo-N-ethylpyridin-2-amine (CID 22504916) is 5-bromo-N-ethylpyridin-2-amine.
What is the SMILES notation for 5-bromo-N-ethylpyridin-2-amine?
The canonical SMILES for 5-bromo-N-ethylpyridin-2-amine is CCNc1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N-ethylpyridin-2-amine?
The InChIKey is PTXWZJGCLYCDFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrN2/c1-2-9-7-4-3-6(8)5-10-7/h3-5H,2H2,1H3,(H,9,10).
What are the key properties of 5-bromo-N-ethylpyridin-2-amine?
5-bromo-N-ethylpyridin-2-amine has a molecular weight of 201.07 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-ethylpyridin-2-amine is sourced from PubChem (CID 22504916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).