4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid

C13H21NO4 — CID 63782265

IUPAC4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
SMILESO=C(O)C1CCC(C(=O)N2CCC(O)CC2)CC1
InChIInChI=1S/C13H21NO4/c15-11-5-7-14(8-6-11)12(16)9-1-3-10(4-2-9)13(17)18/h9-11,15H,1-8H2,(H,17,18)
InChIKeyQUEHGCSJPRYQJM-UHFFFAOYSA-N
MW255.31 g/mol
LogP0.86
Rot. Bonds2

About 4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid

4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid (PubChem CID 63782265) has the molecular formula C13H21NO4 and a molecular weight of 255.31 g/mol. Its IUPAC name is 4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
PubChem CID63782265
Molecular FormulaC13H21NO4
Molecular Weight255.31 g/mol
Exact Mass255.15
IUPAC Name4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
SMILESO=C(O)C1CCC(C(=O)N2CCC(O)CC2)CC1
InChIInChI=1S/C13H21NO4/c15-11-5-7-14(8-6-11)12(16)9-1-3-10(4-2-9)13(17)18/h9-11,15H,1-8H2,(H,17,18)
InChIKeyQUEHGCSJPRYQJM-UHFFFAOYSA-N
XLogP0.86
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.31
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4-aminocyclohexyl)-(4-hydroxypiperidin-1-yl)methanone
CID 20754665
4-(4-acetylpiperazine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 63783969
4-[4-(cyclohexanecarbonyl)piperazine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 120691002
(4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone
CID 112531209
4-[4-(methylcarbamoyl)piperidine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 63784854
(2R)-4-(4-hydroxycyclohexanecarbonyl)-1-methylpiperazine-2-carboxylic acid
CID 98265692
4-(1,4-oxazepane-4-carbonyl)cyclohexane-1-carboxylic acid
CID 63783007
4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 120672794
cyclobutyl-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 66291381
1-(cyclopropanecarbonyl)-N-(4-hydroxycyclohexyl)piperidine-4-carboxamide
CID 43389164
4-(3,4-dimethylpiperazine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 63783353
piperidine-1,4-dicarboxylic acid
CID 18542445

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid?
The IUPAC name of 4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid (CID 63782265) is 4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid.
What is the SMILES notation for 4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid?
The canonical SMILES for 4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid is O=C(O)C1CCC(C(=O)N2CCC(O)CC2)CC1.
What is the InChIKey of 4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid?
The InChIKey is QUEHGCSJPRYQJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO4/c15-11-5-7-14(8-6-11)12(16)9-1-3-10(4-2-9)13(17)18/h9-11,15H,1-8H2,(H,17,18).
What are the key properties of 4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid?
4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid has a molecular weight of 255.31 g/mol, XLogP of 0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid is sourced from PubChem (CID 63782265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).