N-nonylsulfonylacetamide

C11H23NO3S — CID 87711188

IUPACN-nonylsulfonylacetamide
SMILESCCCCCCCCCS(=O)(=O)NC(C)=O
InChIInChI=1S/C11H23NO3S/c1-3-4-5-6-7-8-9-10-16(14,15)12-11(2)13/h3-10H2,1-2H3,(H,12,13)
InChIKeyRJSICWVUNHXWAF-UHFFFAOYSA-N
MW249.38 g/mol
LogP2.20
Rot. Bonds9

About N-nonylsulfonylacetamide

N-nonylsulfonylacetamide (PubChem CID 87711188) has the molecular formula C11H23NO3S and a molecular weight of 249.38 g/mol. Its IUPAC name is N-nonylsulfonylacetamide.

Molecular Properties

Compound NameN-nonylsulfonylacetamide
PubChem CID87711188
Molecular FormulaC11H23NO3S
Molecular Weight249.38 g/mol
Exact Mass249.14
IUPAC NameN-nonylsulfonylacetamide
SMILESCCCCCCCCCS(=O)(=O)NC(C)=O
InChIInChI=1S/C11H23NO3S/c1-3-4-5-6-7-8-9-10-16(14,15)12-11(2)13/h3-10H2,1-2H3,(H,12,13)
InChIKeyRJSICWVUNHXWAF-UHFFFAOYSA-N
XLogP2.20
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-pentylsulfonylundecanamide
CID 87719410
N-(3-bromopropylsulfonyl)acetamide
CID 154090839
N-butylsulfonylhexadecanamide
CID 58954596
potassium 2-(dodecylsulfonylamino)acetate
CID 101284750
potassium 2-(docosylsulfonylamino)acetate
CID 101284759
propyl 2-(hexylsulfonylamino)prop-2-enoate
CID 174510309
2-(nonylsulfonylamino)acetic acid
CID 4052547
2-(tetracosylsulfonylamino)acetic acid
CID 101284702
undecane-1-sulfonohydrazide
CID 174980858
potassium 3-(dodecylsulfonylamino)propanoate
CID 101285229
potassium 3-(octylsulfonylamino)propanoate
CID 101285225
N'-octylsulfonylpropanehydrazide
CID 175512061

Frequently Asked Questions

What is the IUPAC name of N-nonylsulfonylacetamide?
The IUPAC name of N-nonylsulfonylacetamide (CID 87711188) is N-nonylsulfonylacetamide.
What is the SMILES notation for N-nonylsulfonylacetamide?
The canonical SMILES for N-nonylsulfonylacetamide is CCCCCCCCCS(=O)(=O)NC(C)=O.
What is the InChIKey of N-nonylsulfonylacetamide?
The InChIKey is RJSICWVUNHXWAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3S/c1-3-4-5-6-7-8-9-10-16(14,15)12-11(2)13/h3-10H2,1-2H3,(H,12,13).
What are the key properties of N-nonylsulfonylacetamide?
N-nonylsulfonylacetamide has a molecular weight of 249.38 g/mol, XLogP of 2.20, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-nonylsulfonylacetamide is sourced from PubChem (CID 87711188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).