3-bromopyridine;hydrobromide

C5H5Br2N — CID 67321840

IUPAC3-bromopyridine;hydrobromide
SMILESBr.Brc1cccnc1
InChIInChI=1S/C5H4BrN.BrH/c6-5-2-1-3-7-4-5;/h1-4H;1H
InChIKeyYHRIQFQDNNGHPN-UHFFFAOYSA-N
MW238.91 g/mol
LogP2.42
Rot. Bonds

About 3-bromopyridine;hydrobromide

3-bromopyridine;hydrobromide (PubChem CID 67321840) has the molecular formula C5H5Br2N and a molecular weight of 238.91 g/mol. Its IUPAC name is 3-bromopyridine;hydrobromide.

Molecular Properties

Compound Name3-bromopyridine;hydrobromide
PubChem CID67321840
Molecular FormulaC5H5Br2N
Molecular Weight238.91 g/mol
Exact Mass236.88
IUPAC Name3-bromopyridine;hydrobromide
SMILESBr.Brc1cccnc1
InChIInChI=1S/C5H4BrN.BrH/c6-5-2-1-3-7-4-5;/h1-4H;1H
InChIKeyYHRIQFQDNNGHPN-UHFFFAOYSA-N
XLogP2.42
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.91
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-bromopyridine;hydrobromide?
The IUPAC name of 3-bromopyridine;hydrobromide (CID 67321840) is 3-bromopyridine;hydrobromide.
What is the SMILES notation for 3-bromopyridine;hydrobromide?
The canonical SMILES for 3-bromopyridine;hydrobromide is Br.Brc1cccnc1.
What is the InChIKey of 3-bromopyridine;hydrobromide?
The InChIKey is YHRIQFQDNNGHPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4BrN.BrH/c6-5-2-1-3-7-4-5;/h1-4H;1H.
What are the key properties of 3-bromopyridine;hydrobromide?
3-bromopyridine;hydrobromide has a molecular weight of 238.91 g/mol, XLogP of 2.42, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromopyridine;hydrobromide is sourced from PubChem (CID 67321840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).