N-benzhydrylidene-2-trimethylsilylethanesulfonamide

C18H23NO2SSi — CID 11325424

IUPACN-benzhydrylidene-2-trimethylsilylethanesulfonamide
SMILESC[Si](C)(C)CCS(=O)(=O)N=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H23NO2SSi/c1-23(2,3)15-14-22(20,21)19-18(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3
InChIKeyZFAWYIFLHNSRJH-UHFFFAOYSA-N
MW345.54 g/mol
LogP4.19
Rot. Bonds6

About N-benzhydrylidene-2-trimethylsilylethanesulfonamide

N-benzhydrylidene-2-trimethylsilylethanesulfonamide (PubChem CID 11325424) has the molecular formula C18H23NO2SSi and a molecular weight of 345.54 g/mol. Its IUPAC name is N-benzhydrylidene-2-trimethylsilylethanesulfonamide.

Molecular Properties

Compound NameN-benzhydrylidene-2-trimethylsilylethanesulfonamide
PubChem CID11325424
Molecular FormulaC18H23NO2SSi
Molecular Weight345.54 g/mol
Exact Mass345.12
IUPAC NameN-benzhydrylidene-2-trimethylsilylethanesulfonamide
SMILESC[Si](C)(C)CCS(=O)(=O)N=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H23NO2SSi/c1-23(2,3)15-14-22(20,21)19-18(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3
InChIKeyZFAWYIFLHNSRJH-UHFFFAOYSA-N
XLogP4.19
TPSA46.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.54
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-(benzhydrylideneamino)butane-1-sulfonamide
CID 135079545
N-(diphenylmethylene)methanesulfonamide
CID 13140019
(NZ)-N-[(E)-1-(4-fluorophenyl)-3-phenylbut-2-enylidene]methanesulfonamide
CID 176435060
(NE)-N-benzylidene-2-trimethylsilylethanesulfonamide
CID 10825874
[(Z)-[1-(4-benzylphenyl)-2,2,2-trifluoroethylidene]amino] propane-1-sulfonate
CID 87123806
[[1-(4-Benzylphenyl)-2,2,2-trifluoroethylidene]amino] propane-1-sulfonate
CID 87123807
[(2,2-Difluoro-1,2-diphenylethylidene)amino] ethanesulfonate
CID 140455622
N-benzhydrylidene-2-methylpropane-2-sulfonamide
CID 12190238
CID 12190239
CID 12190239
(NE)-N-[(4-methylphenyl)methylidene]-2-trimethylsilylethanesulfonamide
CID 15778085
(NE,R)-N-[(E)-1,3-diphenylprop-2-enylidene]-2-methylpropane-2-sulfinamide
CID 54756550
(NE,R)-2-phenyl-N-(1-phenylethylidene)propane-2-sulfinamide
CID 71664064

Frequently Asked Questions

What is the IUPAC name of N-benzhydrylidene-2-trimethylsilylethanesulfonamide?
The IUPAC name of N-benzhydrylidene-2-trimethylsilylethanesulfonamide (CID 11325424) is N-benzhydrylidene-2-trimethylsilylethanesulfonamide.
What is the SMILES notation for N-benzhydrylidene-2-trimethylsilylethanesulfonamide?
The canonical SMILES for N-benzhydrylidene-2-trimethylsilylethanesulfonamide is C[Si](C)(C)CCS(=O)(=O)N=C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-benzhydrylidene-2-trimethylsilylethanesulfonamide?
The InChIKey is ZFAWYIFLHNSRJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2SSi/c1-23(2,3)15-14-22(20,21)19-18(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3.
What are the key properties of N-benzhydrylidene-2-trimethylsilylethanesulfonamide?
N-benzhydrylidene-2-trimethylsilylethanesulfonamide has a molecular weight of 345.54 g/mol, XLogP of 4.19, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydrylidene-2-trimethylsilylethanesulfonamide is sourced from PubChem (CID 11325424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).