5-bromopyridin-3-ol

C5H4BrNO — CID 599529

IUPAC5-bromopyridin-3-ol
SMILESOc1cncc(Br)c1
InChIInChI=1S/C5H4BrNO/c6-4-1-5(8)3-7-2-4/h1-3,8H
InChIKeyVNYBIBSZZDAEOK-UHFFFAOYSA-N
MW174.00 g/mol
LogP1.55
Rot. Bonds

About 5-bromopyridin-3-ol

5-bromopyridin-3-ol (PubChem CID 599529) has the molecular formula C5H4BrNO and a molecular weight of 174.00 g/mol. Its IUPAC name is 5-bromopyridin-3-ol.

Molecular Properties

Compound Name5-bromopyridin-3-ol
PubChem CID599529
Molecular FormulaC5H4BrNO
Molecular Weight174.00 g/mol
Exact Mass172.95
IUPAC Name5-bromopyridin-3-ol
SMILESOc1cncc(Br)c1
InChIInChI=1S/C5H4BrNO/c6-4-1-5(8)3-7-2-4/h1-3,8H
InChIKeyVNYBIBSZZDAEOK-UHFFFAOYSA-N
XLogP1.55
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.00
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-bromopyridin-3-ol?
The IUPAC name of 5-bromopyridin-3-ol (CID 599529) is 5-bromopyridin-3-ol.
What is the SMILES notation for 5-bromopyridin-3-ol?
The canonical SMILES for 5-bromopyridin-3-ol is Oc1cncc(Br)c1.
What is the InChIKey of 5-bromopyridin-3-ol?
The InChIKey is VNYBIBSZZDAEOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4BrNO/c6-4-1-5(8)3-7-2-4/h1-3,8H.
What are the key properties of 5-bromopyridin-3-ol?
5-bromopyridin-3-ol has a molecular weight of 174.00 g/mol, XLogP of 1.55, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromopyridin-3-ol is sourced from PubChem (CID 599529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).