2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid

C12H21NO3 — CID 71603394

IUPAC2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid
SMILESO=C(O)C1CC(N2CCCCC2)CCC1O
InChIInChI=1S/C12H21NO3/c14-11-5-4-9(8-10(11)12(15)16)13-6-2-1-3-7-13/h9-11,14H,1-8H2,(H,15,16)
InChIKeyLIUYPZMGXGHNOU-UHFFFAOYSA-N
MW227.30 g/mol
LogP1.09
Rot. Bonds2

About 2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid

2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid (PubChem CID 71603394) has the molecular formula C12H21NO3 and a molecular weight of 227.30 g/mol. Its IUPAC name is 2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid
PubChem CID71603394
Molecular FormulaC12H21NO3
Molecular Weight227.30 g/mol
Exact Mass227.15
IUPAC Name2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid
SMILESO=C(O)C1CC(N2CCCCC2)CCC1O
InChIInChI=1S/C12H21NO3/c14-11-5-4-9(8-10(11)12(15)16)13-6-2-1-3-7-13/h9-11,14H,1-8H2,(H,15,16)
InChIKeyLIUYPZMGXGHNOU-UHFFFAOYSA-N
XLogP1.09
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.30
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-piperidin-1-ylcyclohexane-1-carboxylic acid;hydrochloride
CID 69300951
3-(4-hydroxypiperidin-1-yl)cyclopentane-1-carboxylic acid
CID 83821304
2-(2-methylpropanoylamino)-5-pyrrolidin-1-ylcyclohexane-1-carboxylic acid
CID 171423848
2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclobutane-1-carboxylic acid
CID 80997151
1-cyclopropylpiperidine
CID 10909573
1-cyclopropylpiperidine;2,2,2-trifluoroacetic acid
CID 71116090
(2R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-2-carboxylic acid
CID 98202645
2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)cyclobutane-1-carboxylic acid
CID 80996706
3-(4-methylpiperidin-1-yl)cyclohexane-1-carboxylic acid
CID 79695493
3-(4-methylpiperazin-1-yl)cyclohexane-1-carboxylic acid
CID 70920708
(3R)-3-piperazin-1-ylcyclohexane-1-carboxylic acid
CID 70920669
1-(1-cyclopentylpiperidin-4-yl)azepane;oxalic acid
CID 17369286

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid?
The IUPAC name of 2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid (CID 71603394) is 2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid.
What is the SMILES notation for 2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid?
The canonical SMILES for 2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid is O=C(O)C1CC(N2CCCCC2)CCC1O.
What is the InChIKey of 2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid?
The InChIKey is LIUYPZMGXGHNOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO3/c14-11-5-4-9(8-10(11)12(15)16)13-6-2-1-3-7-13/h9-11,14H,1-8H2,(H,15,16).
What are the key properties of 2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid?
2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid has a molecular weight of 227.30 g/mol, XLogP of 1.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-piperidin-1-ylcyclohexane-1-carboxylic acid is sourced from PubChem (CID 71603394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).