1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid

C11H20N2O5S — CID 11587388

IUPAC1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid
SMILESO=C(O)C1(NS(=O)(=O)N2CCOCC2)CCCCC1
InChIInChI=1S/C11H20N2O5S/c14-10(15)11(4-2-1-3-5-11)12-19(16,17)13-6-8-18-9-7-13/h12H,1-9H2,(H,14,15)
InChIKeyYTMZXHLWNJMEGX-UHFFFAOYSA-N
MW292.36 g/mol
LogP-0.06
Rot. Bonds4

About 1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid

1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid (PubChem CID 11587388) has the molecular formula C11H20N2O5S and a molecular weight of 292.36 g/mol. Its IUPAC name is 1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid
PubChem CID11587388
Molecular FormulaC11H20N2O5S
Molecular Weight292.36 g/mol
Exact Mass292.11
IUPAC Name1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid
SMILESO=C(O)C1(NS(=O)(=O)N2CCOCC2)CCCCC1
InChIInChI=1S/C11H20N2O5S/c14-10(15)11(4-2-1-3-5-11)12-19(16,17)13-6-8-18-9-7-13/h12H,1-9H2,(H,14,15)
InChIKeyYTMZXHLWNJMEGX-UHFFFAOYSA-N
XLogP-0.06
TPSA95.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid?
The IUPAC name of 1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid (CID 11587388) is 1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid.
What is the SMILES notation for 1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid?
The canonical SMILES for 1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid is O=C(O)C1(NS(=O)(=O)N2CCOCC2)CCCCC1.
What is the InChIKey of 1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid?
The InChIKey is YTMZXHLWNJMEGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O5S/c14-10(15)11(4-2-1-3-5-11)12-19(16,17)13-6-8-18-9-7-13/h12H,1-9H2,(H,14,15).
What are the key properties of 1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid?
1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid has a molecular weight of 292.36 g/mol, XLogP of -0.06, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(morpholin-4-ylsulfonylamino)cyclohexane-1-carboxylic acid is sourced from PubChem (CID 11587388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).