N-nonylethanesulfonamide

C11H25NO2S — CID 4150370

IUPACN-nonylethanesulfonamide
SMILESCCCCCCCCCNS(=O)(=O)CC
InChIInChI=1S/C11H25NO2S/c1-3-5-6-7-8-9-10-11-12-15(13,14)4-2/h12H,3-11H2,1-2H3
InChIKeyUSZNGUQFNLKROY-UHFFFAOYSA-N
MW235.39 g/mol
LogP2.68
Rot. Bonds10

About N-nonylethanesulfonamide

N-nonylethanesulfonamide (PubChem CID 4150370) has the molecular formula C11H25NO2S and a molecular weight of 235.39 g/mol. Its IUPAC name is N-nonylethanesulfonamide.

Molecular Properties

Compound NameN-nonylethanesulfonamide
PubChem CID4150370
Molecular FormulaC11H25NO2S
Molecular Weight235.39 g/mol
Exact Mass235.16
IUPAC NameN-nonylethanesulfonamide
SMILESCCCCCCCCCNS(=O)(=O)CC
InChIInChI=1S/C11H25NO2S/c1-3-5-6-7-8-9-10-11-12-15(13,14)4-2/h12H,3-11H2,1-2H3
InChIKeyUSZNGUQFNLKROY-UHFFFAOYSA-N
XLogP2.68
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.39
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-nonylethanesulfonamide?
The IUPAC name of N-nonylethanesulfonamide (CID 4150370) is N-nonylethanesulfonamide.
What is the SMILES notation for N-nonylethanesulfonamide?
The canonical SMILES for N-nonylethanesulfonamide is CCCCCCCCCNS(=O)(=O)CC.
What is the InChIKey of N-nonylethanesulfonamide?
The InChIKey is USZNGUQFNLKROY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2S/c1-3-5-6-7-8-9-10-11-12-15(13,14)4-2/h12H,3-11H2,1-2H3.
What are the key properties of N-nonylethanesulfonamide?
N-nonylethanesulfonamide has a molecular weight of 235.39 g/mol, XLogP of 2.68, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-nonylethanesulfonamide is sourced from PubChem (CID 4150370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).