N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide

C₁₇H₃₂N₂O₂SSi — CID 151759845

About N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide

N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide (PubChem CID 151759845) has the molecular formula C₁₇H₃₂N₂O₂SSi and a molecular weight of 356.61 g/mol. Its IUPAC name is N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide.

Molecular Properties

• Compound Name: N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide
• PubChem CID: 151759845
• Molecular Formula: C₁₇H₃₂N₂O₂SSi
• Molecular Weight: 356.61 g/mol
• Exact Mass: 356.20
• IUPAC Name: N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide
• SMILES: CN(C)C(C)(C)c1ccc(S(=O)(=O)N[Si](C)(C)C(C)(C)C)cc1
• InChI: InChI=1S/C17H32N2O2SSi/c1-16(2,3)23(8,9)18-22(20,21)15-12-10-14(11-13-15)17(4,5)19(6)7/h10-13,18H,1-9H3
• InChIKey: RQIDAEGFDZXAEN-UHFFFAOYSA-N
• XLogP: 3.77
• TPSA: 49.41 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 5
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	356.61
LogP ≤ 5	3.77
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide?

The IUPAC name of N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide (CID 151759845) is N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide.

What is the SMILES notation for N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide?

The canonical SMILES for N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide is CN(C)C(C)(C)c1ccc(S(=O)(=O)N[Si](C)(C)C(C)(C)C)cc1.

What is the InChIKey of N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide?

The InChIKey is RQIDAEGFDZXAEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2SSi/c1-16(2,3)23(8,9)18-22(20,21)15-12-10-14(11-13-15)17(4,5)19(6)7/h10-13,18H,1-9H3.

What are the key properties of N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide?

N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide has a molecular weight of 356.61 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-[tert-butyl(dimethyl)silyl]-4-[2-(dimethylamino)propan-2-yl]benzenesulfonamide is sourced from PubChem (CID 151759845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 151759845 — identifiers, structure, computed properties (public domain)

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