1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid

C11H20N2O5S — CID 43552024

IUPAC1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid
SMILESNS(=O)(=O)CCNC(=O)CC1(C(=O)O)CCCCC1
InChIInChI=1S/C11H20N2O5S/c12-19(17,18)7-6-13-9(14)8-11(10(15)16)4-2-1-3-5-11/h1-8H2,(H,13,14)(H,15,16)(H2,12,17,18)
InChIKeyQODXNSNXLIRONY-UHFFFAOYSA-N
MW292.36 g/mol
LogP-0.18
Rot. Bonds6

About 1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid

1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid (PubChem CID 43552024) has the molecular formula C11H20N2O5S and a molecular weight of 292.36 g/mol. Its IUPAC name is 1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid
PubChem CID43552024
Molecular FormulaC11H20N2O5S
Molecular Weight292.36 g/mol
Exact Mass292.11
IUPAC Name1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid
SMILESNS(=O)(=O)CCNC(=O)CC1(C(=O)O)CCCCC1
InChIInChI=1S/C11H20N2O5S/c12-19(17,18)7-6-13-9(14)8-11(10(15)16)4-2-1-3-5-11/h1-8H2,(H,13,14)(H,15,16)(H2,12,17,18)
InChIKeyQODXNSNXLIRONY-UHFFFAOYSA-N
XLogP-0.18
TPSA126.56 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 5-0.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[2-(dimethylsulfamoyl)ethylamino]-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 106334798
2-(1-aminocyclopentyl)-N-(2-sulfamoylethyl)acetamide
CID 64686169
1-[2-[2-(methanesulfonamido)ethylamino]-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 43546068
1-[2-(3-methylsulfonylpropylamino)-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 54906188
1-[2-oxo-2-(propylamino)ethyl]cyclooctane-1-carboxylic acid
CID 102538298
1-[2-oxo-2-(propylamino)ethyl]cyclohexane-1-carboxylic acid
CID 43529270
1-[2-(2-acetamidoethylamino)-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 43402208
1-[2-(3-hydroxypropylamino)-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 60889868
1-[2-(butylamino)-2-oxoethyl]cycloheptane-1-carboxylic acid
CID 43529487
1-[2-oxo-2-(pentylamino)ethyl]cycloheptane-1-carboxylic acid
CID 43529498
1-[2-(2-cyanoethylamino)-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 54867554
1-[2-(6-hydroxyhexylamino)-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 107846493

Frequently Asked Questions

What is the IUPAC name of 1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid?
The IUPAC name of 1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid (CID 43552024) is 1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid.
What is the SMILES notation for 1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid?
The canonical SMILES for 1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid is NS(=O)(=O)CCNC(=O)CC1(C(=O)O)CCCCC1.
What is the InChIKey of 1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid?
The InChIKey is QODXNSNXLIRONY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O5S/c12-19(17,18)7-6-13-9(14)8-11(10(15)16)4-2-1-3-5-11/h1-8H2,(H,13,14)(H,15,16)(H2,12,17,18).
What are the key properties of 1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid?
1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid has a molecular weight of 292.36 g/mol, XLogP of -0.18, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-oxo-2-(2-sulfamoylethylamino)ethyl]cyclohexane-1-carboxylic acid is sourced from PubChem (CID 43552024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).