2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide

C11H23N3O3S — CID 65240880

IUPAC2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide
SMILESCNC1(CC(=O)NCCS(N)(=O)=O)CCCCC1
InChIInChI=1S/C11H23N3O3S/c1-13-11(5-3-2-4-6-11)9-10(15)14-7-8-18(12,16)17/h13H,2-9H2,1H3,(H,14,15)(H2,12,16,17)
InChIKeyINKHGBSAECOQNQ-UHFFFAOYSA-N
MW277.39 g/mol
LogP-0.30
Rot. Bonds6

About 2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide

2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide (PubChem CID 65240880) has the molecular formula C11H23N3O3S and a molecular weight of 277.39 g/mol. Its IUPAC name is 2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide.

Molecular Properties

Compound Name2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide
PubChem CID65240880
Molecular FormulaC11H23N3O3S
Molecular Weight277.39 g/mol
Exact Mass277.15
IUPAC Name2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide
SMILESCNC1(CC(=O)NCCS(N)(=O)=O)CCCCC1
InChIInChI=1S/C11H23N3O3S/c1-13-11(5-3-2-4-6-11)9-10(15)14-7-8-18(12,16)17/h13H,2-9H2,1H3,(H,14,15)(H2,12,16,17)
InChIKeyINKHGBSAECOQNQ-UHFFFAOYSA-N
XLogP-0.30
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide?
The IUPAC name of 2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide (CID 65240880) is 2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide.
What is the SMILES notation for 2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide?
The canonical SMILES for 2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide is CNC1(CC(=O)NCCS(N)(=O)=O)CCCCC1.
What is the InChIKey of 2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide?
The InChIKey is INKHGBSAECOQNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3S/c1-13-11(5-3-2-4-6-11)9-10(15)14-7-8-18(12,16)17/h13H,2-9H2,1H3,(H,14,15)(H2,12,16,17).
What are the key properties of 2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide?
2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide has a molecular weight of 277.39 g/mol, XLogP of -0.30, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(methylamino)cyclohexyl]-N-(2-sulfamoylethyl)acetamide is sourced from PubChem (CID 65240880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).