6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid

C12H14N2O4 — CID 71212709

IUPAC6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(N2CCC(C(=O)O)CC2)nc1
InChIInChI=1S/C12H14N2O4/c15-11(16)8-3-5-14(6-4-8)10-2-1-9(7-13-10)12(17)18/h1-2,7-8H,3-6H2,(H,15,16)(H,17,18)
InChIKeyKIRPGRBBVDFAJW-UHFFFAOYSA-N
MW250.25 g/mol
LogP1.08
Rot. Bonds3

About 6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid

6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid (PubChem CID 71212709) has the molecular formula C12H14N2O4 and a molecular weight of 250.25 g/mol. Its IUPAC name is 6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid
PubChem CID71212709
Molecular FormulaC12H14N2O4
Molecular Weight250.25 g/mol
Exact Mass250.10
IUPAC Name6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(N2CCC(C(=O)O)CC2)nc1
InChIInChI=1S/C12H14N2O4/c15-11(16)8-3-5-14(6-4-8)10-2-1-9(7-13-10)12(17)18/h1-2,7-8H,3-6H2,(H,15,16)(H,17,18)
InChIKeyKIRPGRBBVDFAJW-UHFFFAOYSA-N
XLogP1.08
TPSA90.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.25
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid with MolForge

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

Launch Full Analysis

Related Compounds

1-(5-acetyl-2-pyridinyl)piperidine-4-carboxylic acid
CID 66656112
6-piperidin-1-ylpyridine-3-carboxylic acid
CID 2794761
1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid
CID 67234813
6-[4-(dimethylamino)piperidin-1-yl]pyridine-3-carboxylic acid
CID 43586285
1-(5-chloro-2-pyridinyl)piperidine-4-carboxylic acid
CID 16787048
6-[(3R,4R)-4-hydroxy-3-methylpiperidin-1-yl]pyridine-3-carboxylic acid
CID 129445649
6-(4-methylsulfanylazepan-1-yl)pyridine-3-carboxylic acid
CID 114237506
6-(4-phenylpiperazin-1-yl)pyridine-3-carboxylic acid
CID 23432931
6-(4-formylpiperazin-1-yl)pyridine-3-carboxylic acid
CID 82116544
6-[4-(1-cyclobutylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-3-carboxylic acid
CID 69353827
1-[5-(dimethylsulfamoyl)-2-pyridinyl]piperidine-4-carboxylic acid
CID 103340811
6-[(3S)-3-(methoxymethyl)pyrrolidin-1-yl]pyridine-3-carboxylic acid
CID 129371025

Frequently Asked Questions

What is the IUPAC name of 6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid?
The IUPAC name of 6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid (CID 71212709) is 6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid?
The canonical SMILES for 6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid is O=C(O)c1ccc(N2CCC(C(=O)O)CC2)nc1.
What is the InChIKey of 6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid?
The InChIKey is KIRPGRBBVDFAJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O4/c15-11(16)8-3-5-14(6-4-8)10-2-1-9(7-13-10)12(17)18/h1-2,7-8H,3-6H2,(H,15,16)(H,17,18).
What are the key properties of 6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid?
6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid has a molecular weight of 250.25 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-carboxypiperidin-1-yl)pyridine-3-carboxylic acid is sourced from PubChem (CID 71212709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).