3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid

C13H22N2O4 — CID 55147885

IUPAC3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
SMILESO=C(O)C1CCCC(NC(=O)N2CCCC(O)C2)C1
InChIInChI=1S/C13H22N2O4/c16-11-5-2-6-15(8-11)13(19)14-10-4-1-3-9(7-10)12(17)18/h9-11,16H,1-8H2,(H,14,19)(H,17,18)
InChIKeyZUAUFUNFHJGWMT-UHFFFAOYSA-N
MW270.33 g/mol
LogP0.80
Rot. Bonds2

About 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid

3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid (PubChem CID 55147885) has the molecular formula C13H22N2O4 and a molecular weight of 270.33 g/mol. Its IUPAC name is 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
PubChem CID55147885
Molecular FormulaC13H22N2O4
Molecular Weight270.33 g/mol
Exact Mass270.16
IUPAC Name3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
SMILESO=C(O)C1CCCC(NC(=O)N2CCCC(O)C2)C1
InChIInChI=1S/C13H22N2O4/c16-11-5-2-6-15(8-11)13(19)14-10-4-1-3-9(7-10)12(17)18/h9-11,16H,1-8H2,(H,14,19)(H,17,18)
InChIKeyZUAUFUNFHJGWMT-UHFFFAOYSA-N
XLogP0.80
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-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

3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 66033013
3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide
CID 110896538
3-[[3-(methylaminomethyl)piperidine-1-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 63041940
(3S)-1-[(3-ethylcyclohexyl)carbamoyl]piperidine-3-carboxylic acid
CID 81126411
(3S)-1-[(3,5-dimethylcyclohexyl)carbamoyl]piperidine-3-carboxylic acid
CID 81126261
1-[[(1S,3R)-3-(piperidine-1-carbonyl)cyclopentyl]carbamoyl]piperidine-3-carboxylic acid
CID 122013071
3-[[3-(methylcarbamoyl)piperidine-1-carbonyl]amino]cyclopentane-1-carboxylic acid
CID 103197211
3-[(3-ethylpyrrolidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 113418310
3-[(3-methoxycarbonylpiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 115535206
cis-(1R,3S)-3-(azocane-1-carbonylamino)cyclopentane-1-carboxylic acid
CID 106324241
3-(thiomorpholine-4-carbonylamino)cyclohexane-1-carboxylic acid
CID 63041930
3-[(4-aminopiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 55147693

Frequently Asked Questions

What is the IUPAC name of 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid?
The IUPAC name of 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid (CID 55147885) is 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid.
What is the SMILES notation for 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid?
The canonical SMILES for 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid is O=C(O)C1CCCC(NC(=O)N2CCCC(O)C2)C1.
What is the InChIKey of 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid?
The InChIKey is ZUAUFUNFHJGWMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O4/c16-11-5-2-6-15(8-11)13(19)14-10-4-1-3-9(7-10)12(17)18/h9-11,16H,1-8H2,(H,14,19)(H,17,18).
What are the key properties of 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid?
3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid has a molecular weight of 270.33 g/mol, XLogP of 0.80, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid is sourced from PubChem (CID 55147885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).