3,5-dibromopyridin-4-amine

C5H4Br2N2 — CID 619792

IUPAC3,5-dibromopyridin-4-amine
SMILESNc1c(Br)cncc1Br
InChIInChI=1S/C5H4Br2N2/c6-3-1-9-2-4(7)5(3)8/h1-2H,(H2,8,9)
InChIKeyMNRBVTDLMUNVLD-UHFFFAOYSA-N
MW251.91 g/mol
LogP2.19
Rot. Bonds

About 3,5-dibromopyridin-4-amine

3,5-dibromopyridin-4-amine (PubChem CID 619792) has the molecular formula C5H4Br2N2 and a molecular weight of 251.91 g/mol. Its IUPAC name is 3,5-dibromopyridin-4-amine.

Molecular Properties

Compound Name3,5-dibromopyridin-4-amine
PubChem CID619792
Molecular FormulaC5H4Br2N2
Molecular Weight251.91 g/mol
Exact Mass249.87
IUPAC Name3,5-dibromopyridin-4-amine
SMILESNc1c(Br)cncc1Br
InChIInChI=1S/C5H4Br2N2/c6-3-1-9-2-4(7)5(3)8/h1-2H,(H2,8,9)
InChIKeyMNRBVTDLMUNVLD-UHFFFAOYSA-N
XLogP2.19
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.91
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dibromopyridin-4-amine?
The IUPAC name of 3,5-dibromopyridin-4-amine (CID 619792) is 3,5-dibromopyridin-4-amine.
What is the SMILES notation for 3,5-dibromopyridin-4-amine?
The canonical SMILES for 3,5-dibromopyridin-4-amine is Nc1c(Br)cncc1Br.
What is the InChIKey of 3,5-dibromopyridin-4-amine?
The InChIKey is MNRBVTDLMUNVLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4Br2N2/c6-3-1-9-2-4(7)5(3)8/h1-2H,(H2,8,9).
What are the key properties of 3,5-dibromopyridin-4-amine?
3,5-dibromopyridin-4-amine has a molecular weight of 251.91 g/mol, XLogP of 2.19, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromopyridin-4-amine is sourced from PubChem (CID 619792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).