2-hydroxy-5-pyridin-3-ylbenzoic acid

C12H9NO3 — CID 46316976

IUPAC2-hydroxy-5-pyridin-3-ylbenzoic acid
SMILESO=C(O)c1cc(-c2cccnc2)ccc1O
InChIInChI=1S/C12H9NO3/c14-11-4-3-8(6-10(11)12(15)16)9-2-1-5-13-7-9/h1-7,14H,(H,15,16)
InChIKeyGJSFZMHGFSKOAK-UHFFFAOYSA-N
MW215.21 g/mol
LogP2.15
Rot. Bonds2

About 2-hydroxy-5-pyridin-3-ylbenzoic acid

2-hydroxy-5-pyridin-3-ylbenzoic acid (PubChem CID 46316976) has the molecular formula C12H9NO3 and a molecular weight of 215.21 g/mol. Its IUPAC name is 2-hydroxy-5-pyridin-3-ylbenzoic acid.

Molecular Properties

Compound Name2-hydroxy-5-pyridin-3-ylbenzoic acid
PubChem CID46316976
Molecular FormulaC12H9NO3
Molecular Weight215.21 g/mol
Exact Mass215.06
IUPAC Name2-hydroxy-5-pyridin-3-ylbenzoic acid
SMILESO=C(O)c1cc(-c2cccnc2)ccc1O
InChIInChI=1S/C12H9NO3/c14-11-4-3-8(6-10(11)12(15)16)9-2-1-5-13-7-9/h1-7,14H,(H,15,16)
InChIKeyGJSFZMHGFSKOAK-UHFFFAOYSA-N
XLogP2.15
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-hydroxy-5-pyridin-3-ylbenzoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-pyridin-3-ylbenzoic acid?
The IUPAC name of 2-hydroxy-5-pyridin-3-ylbenzoic acid (CID 46316976) is 2-hydroxy-5-pyridin-3-ylbenzoic acid.
What is the SMILES notation for 2-hydroxy-5-pyridin-3-ylbenzoic acid?
The canonical SMILES for 2-hydroxy-5-pyridin-3-ylbenzoic acid is O=C(O)c1cc(-c2cccnc2)ccc1O.
What is the InChIKey of 2-hydroxy-5-pyridin-3-ylbenzoic acid?
The InChIKey is GJSFZMHGFSKOAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NO3/c14-11-4-3-8(6-10(11)12(15)16)9-2-1-5-13-7-9/h1-7,14H,(H,15,16).
What are the key properties of 2-hydroxy-5-pyridin-3-ylbenzoic acid?
2-hydroxy-5-pyridin-3-ylbenzoic acid has a molecular weight of 215.21 g/mol, XLogP of 2.15, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-pyridin-3-ylbenzoic acid is sourced from PubChem (CID 46316976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).