N,N-diethyl-4-trimethylsilylbenzenesulfonamide

C13H23NO2SSi — CID 11254658

IUPACN,N-diethyl-4-trimethylsilylbenzenesulfonamide
SMILESCCN(CC)S(=O)(=O)c1ccc([Si](C)(C)C)cc1
InChIInChI=1S/C13H23NO2SSi/c1-6-14(7-2)17(15,16)12-8-10-13(11-9-12)18(3,4)5/h8-11H,6-7H2,1-5H3
InChIKeyRVVQLEPELFIKOA-UHFFFAOYSA-N
MW285.49 g/mol
LogP2.26
Rot. Bonds5

About N,N-diethyl-4-trimethylsilylbenzenesulfonamide

N,N-diethyl-4-trimethylsilylbenzenesulfonamide (PubChem CID 11254658) has the molecular formula C13H23NO2SSi and a molecular weight of 285.49 g/mol. Its IUPAC name is N,N-diethyl-4-trimethylsilylbenzenesulfonamide.

Molecular Properties

Compound NameN,N-diethyl-4-trimethylsilylbenzenesulfonamide
PubChem CID11254658
Molecular FormulaC13H23NO2SSi
Molecular Weight285.49 g/mol
Exact Mass285.12
IUPAC NameN,N-diethyl-4-trimethylsilylbenzenesulfonamide
SMILESCCN(CC)S(=O)(=O)c1ccc([Si](C)(C)C)cc1
InChIInChI=1S/C13H23NO2SSi/c1-6-14(7-2)17(15,16)12-8-10-13(11-9-12)18(3,4)5/h8-11H,6-7H2,1-5H3
InChIKeyRVVQLEPELFIKOA-UHFFFAOYSA-N
XLogP2.26
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.49
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[4-(diethylsulfamoyl)phenyl]azanium
CID 163754929
N,N-diethyl-4-sulfanylbenzenesulfonamide
CID 15027344
4-(dimethylamino)-N,N-diethylbenzenesulfonamide
CID 11043368
[4-(diethylsulfamoyl)phenyl]methylazanium
CID 7129046
N,N-diethyl-4-(N-phenylanilino)benzenesulfonamide
CID 20654617
4-(2-deuterioethynyl)-N,N-diethylbenzenesulfonamide
CID 163281778
4-(2-amino-1,1,1,3,3,3-hexafluoropropan-2-yl)-N,N-diethylbenzenesulfonamide
CID 24996616
N,N-diethyl-4-(2-methyl-1,3-oxazol-5-yl)benzenesulfonamide
CID 20958862
N,N-diethyl-4-(2-methyl-1,3-oxazol-4-yl)benzenesulfonamide
CID 22583148
2-amino-2-[4-(diethylsulfamoyl)phenyl]acetic acid
CID 5179933
N,N-diethyl-4-(ethylaminomethyl)benzenesulfonamide
CID 28715770
N,N-diethyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 2866313

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-trimethylsilylbenzenesulfonamide?
The IUPAC name of N,N-diethyl-4-trimethylsilylbenzenesulfonamide (CID 11254658) is N,N-diethyl-4-trimethylsilylbenzenesulfonamide.
What is the SMILES notation for N,N-diethyl-4-trimethylsilylbenzenesulfonamide?
The canonical SMILES for N,N-diethyl-4-trimethylsilylbenzenesulfonamide is CCN(CC)S(=O)(=O)c1ccc([Si](C)(C)C)cc1.
What is the InChIKey of N,N-diethyl-4-trimethylsilylbenzenesulfonamide?
The InChIKey is RVVQLEPELFIKOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2SSi/c1-6-14(7-2)17(15,16)12-8-10-13(11-9-12)18(3,4)5/h8-11H,6-7H2,1-5H3.
What are the key properties of N,N-diethyl-4-trimethylsilylbenzenesulfonamide?
N,N-diethyl-4-trimethylsilylbenzenesulfonamide has a molecular weight of 285.49 g/mol, XLogP of 2.26, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-trimethylsilylbenzenesulfonamide is sourced from PubChem (CID 11254658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).