2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid

C12H20N2O4 — CID 568377

IUPAC2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid
SMILESO=C(O)C1CCCCC1C(=O)NN1CCOCC1
InChIInChI=1S/C12H20N2O4/c15-11(13-14-5-7-18-8-6-14)9-3-1-2-4-10(9)12(16)17/h9-10H,1-8H2,(H,13,15)(H,16,17)
InChIKeyBUEGOBZNNRGGOC-UHFFFAOYSA-N
MW256.30 g/mol
LogP0.24
Rot. Bonds3

About 2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid

2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid (PubChem CID 568377) has the molecular formula C12H20N2O4 and a molecular weight of 256.30 g/mol. Its IUPAC name is 2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid
PubChem CID568377
Molecular FormulaC12H20N2O4
Molecular Weight256.30 g/mol
Exact Mass256.14
IUPAC Name2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid
SMILESO=C(O)C1CCCCC1C(=O)NN1CCOCC1
InChIInChI=1S/C12H20N2O4/c15-11(13-14-5-7-18-8-6-14)9-3-1-2-4-10(9)12(16)17/h9-10H,1-8H2,(H,13,15)(H,16,17)
InChIKeyBUEGOBZNNRGGOC-UHFFFAOYSA-N
XLogP0.24
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(morpholin-4-ylcarbamoyl)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

2-(aminomethyl)-N-morpholin-4-ylcyclopentane-1-carboxamide
CID 83015994
(2R,5S)-5-(morpholin-4-ylcarbamoyl)oxolane-2-carboxylic acid
CID 102945598
trans-(1R,2R)-2-[(4-morpholin-4-ylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 27516821
(1R,2R,3R,4R)-3-(morpholin-4-ylcarbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
CID 124713675
trans-(1S,2S)-2-[[4-(morpholine-4-carbonyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 1080146
N-morpholin-4-yl-7-azabicyclo[2.2.1]heptane-2-carboxamide
CID 83016011
7-(morpholin-4-ylcarbamoyl)-7-azabicyclo[2.2.1]heptane-2-carboxylic acid
CID 83019769
2-[[4-(hydroxymethyl)oxan-4-yl]carbamoyl]cyclohexane-1-carboxylic acid
CID 106296956
3-methyl-N-morpholin-4-ylpyrrolidine-2-carboxamide
CID 102779940
trans-(1R,2R)-cyclohexane-1,2-dicarboxylic acid;hydrochloride
CID 70535628
trans-(1S,2S)-2-[[(1S,2R)-2-[[(1S,2R)-2-carboxycyclohexanecarbonyl]amino]cyclohexyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 124780718
3-methyl-N-morpholin-4-ylpiperidine-1-carboxamide
CID 116657340

Frequently Asked Questions

What is the IUPAC name of 2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid?
The IUPAC name of 2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid (CID 568377) is 2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid.
What is the SMILES notation for 2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid?
The canonical SMILES for 2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid is O=C(O)C1CCCCC1C(=O)NN1CCOCC1.
What is the InChIKey of 2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid?
The InChIKey is BUEGOBZNNRGGOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O4/c15-11(13-14-5-7-18-8-6-14)9-3-1-2-4-10(9)12(16)17/h9-10H,1-8H2,(H,13,15)(H,16,17).
What are the key properties of 2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid?
2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid has a molecular weight of 256.30 g/mol, XLogP of 0.24, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(morpholin-4-ylcarbamoyl)cyclohexane-1-carboxylic acid is sourced from PubChem (CID 568377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).