5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid

C13H11NO3 — CID 10263201

IUPAC5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid
SMILESO=C(O)c1ccc([C@H](O)c2ccccc2)cn1
InChIInChI=1S/C13H11NO3/c15-12(9-4-2-1-3-5-9)10-6-7-11(13(16)17)14-8-10/h1-8,12,15H,(H,16,17)/t12-/m1/s1
InChIKeyBMTGCDDXYNEVRV-GFCCVEGCSA-N
MW229.24 g/mol
LogP1.86
Rot. Bonds3

About 5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid

5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid (PubChem CID 10263201) has the molecular formula C13H11NO3 and a molecular weight of 229.24 g/mol. Its IUPAC name is 5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid
PubChem CID10263201
Molecular FormulaC13H11NO3
Molecular Weight229.24 g/mol
Exact Mass229.07
IUPAC Name5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid
SMILESO=C(O)c1ccc([C@H](O)c2ccccc2)cn1
InChIInChI=1S/C13H11NO3/c15-12(9-4-2-1-3-5-9)10-6-7-11(13(16)17)14-8-10/h1-8,12,15H,(H,16,17)/t12-/m1/s1
InChIKeyBMTGCDDXYNEVRV-GFCCVEGCSA-N
XLogP1.86
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid?
The IUPAC name of 5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid (CID 10263201) is 5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid?
The canonical SMILES for 5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid is O=C(O)c1ccc([C@H](O)c2ccccc2)cn1.
What is the InChIKey of 5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid?
The InChIKey is BMTGCDDXYNEVRV-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H11NO3/c15-12(9-4-2-1-3-5-9)10-6-7-11(13(16)17)14-8-10/h1-8,12,15H,(H,16,17)/t12-/m1/s1.
What are the key properties of 5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid?
5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid has a molecular weight of 229.24 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(R)-hydroxy(phenyl)methyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 10263201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).