2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol

C₁₄H₂₈N₂O₂S₂Si — CID 151374522

About 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol

2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol (PubChem CID 151374522) has the molecular formula C₁₄H₂₈N₂O₂S₂Si and a molecular weight of 348.61 g/mol. Its IUPAC name is 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol.

Molecular Properties

• Compound Name: 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol
• PubChem CID: 151374522
• Molecular Formula: C₁₄H₂₈N₂O₂S₂Si
• Molecular Weight: 348.61 g/mol
• Exact Mass: 348.14
• IUPAC Name: 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol
• SMILES: [H]N=S(=O)(N[Si](C)(C)C(C)(C)C)c1cc(C(C)(C)O)c(C)s1
• InChI: InChI=1S/C14H28N2O2S2Si/c1-10-11(14(5,6)17)9-12(19-10)20(15,18)16-21(7,8)13(2,3)4/h9,17H,1-8H3,(H2,15,16,18)
• InChIKey: ORDKMOOQBPMCTB-UHFFFAOYSA-N
• XLogP: 4.20
• TPSA: 73.18 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	348.61
LogP ≤ 5	4.20
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol?

The IUPAC name of 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol (CID 151374522) is 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol.

What is the SMILES notation for 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol?

The canonical SMILES for 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol is [H]N=S(=O)(N[Si](C)(C)C(C)(C)C)c1cc(C(C)(C)O)c(C)s1.

What is the InChIKey of 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol?

The InChIKey is ORDKMOOQBPMCTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2S2Si/c1-10-11(14(5,6)17)9-12(19-10)20(15,18)16-21(7,8)13(2,3)4/h9,17H,1-8H3,(H2,15,16,18).

What are the key properties of 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol?

2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol has a molecular weight of 348.61 g/mol, XLogP of 4.20, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-[[[tert-butyl(dimethyl)silyl]amino]sulfonimidoyl]-2-methylthiophen-3-yl]propan-2-ol is sourced from PubChem (CID 151374522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 151374522 — identifiers, structure, computed properties (public domain)

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