3-piperidin-1-ylpiperidine-2-carboxylic acid

C11H20N2O2 — CID 83835245

IUPAC3-piperidin-1-ylpiperidine-2-carboxylic acid
SMILESO=C(O)C1NCCCC1N1CCCCC1
InChIInChI=1S/C11H20N2O2/c14-11(15)10-9(5-4-6-12-10)13-7-2-1-3-8-13/h9-10,12H,1-8H2,(H,14,15)
InChIKeyGESNNBGTJNQXLI-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.68
Rot. Bonds2

About 3-piperidin-1-ylpiperidine-2-carboxylic acid

3-piperidin-1-ylpiperidine-2-carboxylic acid (PubChem CID 83835245) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 3-piperidin-1-ylpiperidine-2-carboxylic acid.

Molecular Properties

Compound Name3-piperidin-1-ylpiperidine-2-carboxylic acid
PubChem CID83835245
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name3-piperidin-1-ylpiperidine-2-carboxylic acid
SMILESO=C(O)C1NCCCC1N1CCCCC1
InChIInChI=1S/C11H20N2O2/c14-11(15)10-9(5-4-6-12-10)13-7-2-1-3-8-13/h9-10,12H,1-8H2,(H,14,15)
InChIKeyGESNNBGTJNQXLI-UHFFFAOYSA-N
XLogP0.68
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3R)-3-piperidin-1-ylpyrrolidine-2-carboxylic acid
CID 118101021
(1S,8aS)-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine-1-carboxylic acid
CID 11480691
1-azabicyclo[4.2.0]octane-7-carboxylic acid
CID 82651829
3-hydroxypiperidine-2-carboxylic acid;hydrochloride
CID 72996039
(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine-1-carboxylic acid
CID 7758382
1,2,3,5,6,7,8,8a-octahydroindolizine-1-carboxylic acid
CID 82653045
1,2,3,5,6,7,8,8a-octahydroindolizine-8-carboxylic acid
CID 75987984
3-oxo-2,5,6,7,8,8a-hexahydro-1H-imidazo[1,5-a]pyrazine-8-carboxylic acid
CID 145294658
9-pyrrolidin-1-yl-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-cyclohepta[b]pyridine
CID 19890892
(3R)-1-(3-methylpiperidine-2-carbonyl)piperidine-3-carboxylic acid
CID 107068398
5-[[(2S,3R)-3-piperidin-1-ylpyrrolidine-2-carbonyl]amino]-1-benzofuran-2-carboxylic acid;dihydrochloride
CID 118088689
(2R,3R)-piperazine-2,3-dicarboxylic acid
CID 29413693

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-ylpiperidine-2-carboxylic acid?
The IUPAC name of 3-piperidin-1-ylpiperidine-2-carboxylic acid (CID 83835245) is 3-piperidin-1-ylpiperidine-2-carboxylic acid.
What is the SMILES notation for 3-piperidin-1-ylpiperidine-2-carboxylic acid?
The canonical SMILES for 3-piperidin-1-ylpiperidine-2-carboxylic acid is O=C(O)C1NCCCC1N1CCCCC1.
What is the InChIKey of 3-piperidin-1-ylpiperidine-2-carboxylic acid?
The InChIKey is GESNNBGTJNQXLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c14-11(15)10-9(5-4-6-12-10)13-7-2-1-3-8-13/h9-10,12H,1-8H2,(H,14,15).
What are the key properties of 3-piperidin-1-ylpiperidine-2-carboxylic acid?
3-piperidin-1-ylpiperidine-2-carboxylic acid has a molecular weight of 212.29 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-ylpiperidine-2-carboxylic acid is sourced from PubChem (CID 83835245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).