N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide

C11H24N2O3S — CID 83039706

IUPACN-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide
SMILESCOCCNCCNS(=O)(=O)C1CCCCC1
InChIInChI=1S/C11H24N2O3S/c1-16-10-9-12-7-8-13-17(14,15)11-5-3-2-4-6-11/h11-13H,2-10H2,1H3
InChIKeyYKTFBGHDHXZRPU-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.47
Rot. Bonds8

About N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide

N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide (PubChem CID 83039706) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide.

Molecular Properties

Compound NameN-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide
PubChem CID83039706
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC NameN-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide
SMILESCOCCNCCNS(=O)(=O)C1CCCCC1
InChIInChI=1S/C11H24N2O3S/c1-16-10-9-12-7-8-13-17(14,15)11-5-3-2-4-6-11/h11-13H,2-10H2,1H3
InChIKeyYKTFBGHDHXZRPU-UHFFFAOYSA-N
XLogP0.47
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide?
The IUPAC name of N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide (CID 83039706) is N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide.
What is the SMILES notation for N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide?
The canonical SMILES for N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide is COCCNCCNS(=O)(=O)C1CCCCC1.
What is the InChIKey of N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide?
The InChIKey is YKTFBGHDHXZRPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-16-10-9-12-7-8-13-17(14,15)11-5-3-2-4-6-11/h11-13H,2-10H2,1H3.
What are the key properties of N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide?
N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide has a molecular weight of 264.39 g/mol, XLogP of 0.47, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethylamino)ethyl]cyclohexanesulfonamide is sourced from PubChem (CID 83039706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).