1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid

C11H14N2O3 — CID 67234813

IUPAC1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(c2ccc(O)cn2)CC1
InChIInChI=1S/C11H14N2O3/c14-9-1-2-10(12-7-9)13-5-3-8(4-6-13)11(15)16/h1-2,7-8,14H,3-6H2,(H,15,16)
InChIKeyPGYJOXVIJDRQJU-UHFFFAOYSA-N
MW222.24 g/mol
LogP1.09
Rot. Bonds2

About 1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid

1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid (PubChem CID 67234813) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is 1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid
PubChem CID67234813
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(c2ccc(O)cn2)CC1
InChIInChI=1S/C11H14N2O3/c14-9-1-2-10(12-7-9)13-5-3-8(4-6-13)11(15)16/h1-2,7-8,14H,3-6H2,(H,15,16)
InChIKeyPGYJOXVIJDRQJU-UHFFFAOYSA-N
XLogP1.09
TPSA73.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid?
The IUPAC name of 1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid (CID 67234813) is 1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid.
What is the SMILES notation for 1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid?
The canonical SMILES for 1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid is O=C(O)C1CCN(c2ccc(O)cn2)CC1.
What is the InChIKey of 1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid?
The InChIKey is PGYJOXVIJDRQJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c14-9-1-2-10(12-7-9)13-5-3-8(4-6-13)11(15)16/h1-2,7-8,14H,3-6H2,(H,15,16).
What are the key properties of 1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid?
1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid has a molecular weight of 222.24 g/mol, XLogP of 1.09, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid is sourced from PubChem (CID 67234813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).