N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide

C12H21NO2SSi — CID 10730846

IUPACN-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide
SMILESCCNS(=O)(=O)c1ccc(C)cc1[Si](C)(C)C
InChIInChI=1S/C12H21NO2SSi/c1-6-13-16(14,15)11-8-7-10(2)9-12(11)17(3,4)5/h7-9,13H,6H2,1-5H3
InChIKeyQOGSHXCUVOZYIB-UHFFFAOYSA-N
MW271.46 g/mol
LogP1.84
Rot. Bonds4

About N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide

N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide (PubChem CID 10730846) has the molecular formula C12H21NO2SSi and a molecular weight of 271.46 g/mol. Its IUPAC name is N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide.

Molecular Properties

Compound NameN-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide
PubChem CID10730846
Molecular FormulaC12H21NO2SSi
Molecular Weight271.46 g/mol
Exact Mass271.11
IUPAC NameN-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide
SMILESCCNS(=O)(=O)c1ccc(C)cc1[Si](C)(C)C
InChIInChI=1S/C12H21NO2SSi/c1-6-13-16(14,15)11-8-7-10(2)9-12(11)17(3,4)5/h7-9,13H,6H2,1-5H3
InChIKeyQOGSHXCUVOZYIB-UHFFFAOYSA-N
XLogP1.84
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.46
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-2-fluoro-4-methylbenzenesulfonamide
CID 130158865
2-[ethyl(dimethyl)silyl]-4-methylbenzenesulfonic acid
CID 87329485
N-ethyl-4-methyl-2-(3-methylphenoxy)benzenesulfonamide
CID 10804527
2-amino-N-(2-hydroxyethyl)-4-methylbenzenesulfonamide
CID 43258900
2-amino-4-methyl-N-prop-2-ynylbenzenesulfonamide
CID 61111569
2-amino-N-(2-ethoxyethyl)-4-methylbenzenesulfonamide
CID 43590960
N-[3-(ethylamino)propyl]-2,5-dimethylbenzenesulfonamide
CID 43606579
2-amino-4-methyl-N-prop-2-enylbenzenesulfonamide
CID 61112895
2-amino-4-methyl-N-(1H-1,2,4-triazol-5-ylmethyl)benzenesulfonamide
CID 61113449
4-bromo-N-ethyl-2-fluorobenzenesulfonamide
CID 116527445
2-chloro-N-ethyl-4-fluorobenzenesulfonamide
CID 18338331
N-butyl-2,5-dimethylbenzenesulfonamide
CID 2414109

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide?
The IUPAC name of N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide (CID 10730846) is N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide.
What is the SMILES notation for N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide?
The canonical SMILES for N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide is CCNS(=O)(=O)c1ccc(C)cc1[Si](C)(C)C.
What is the InChIKey of N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide?
The InChIKey is QOGSHXCUVOZYIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2SSi/c1-6-13-16(14,15)11-8-7-10(2)9-12(11)17(3,4)5/h7-9,13H,6H2,1-5H3.
What are the key properties of N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide?
N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide has a molecular weight of 271.46 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-2-trimethylsilylbenzenesulfonamide is sourced from PubChem (CID 10730846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).