5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide

C14H19NO3S2Si — CID 10569266

IUPAC5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide
SMILESC[Si](C)(C)OC(c1ccccc1)c1cc(S(N)(=O)=O)cs1
InChIInChI=1S/C14H19NO3S2Si/c1-21(2,3)18-14(11-7-5-4-6-8-11)13-9-12(10-19-13)20(15,16)17/h4-10,14H,1-3H3,(H2,15,16,17)
InChIKeyCIBNKWBIZOWYGC-UHFFFAOYSA-N
MW341.53 g/mol
LogP3.34
Rot. Bonds5

About 5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide

5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide (PubChem CID 10569266) has the molecular formula C14H19NO3S2Si and a molecular weight of 341.53 g/mol. Its IUPAC name is 5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide.

Molecular Properties

Compound Name5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide
PubChem CID10569266
Molecular FormulaC14H19NO3S2Si
Molecular Weight341.53 g/mol
Exact Mass341.06
IUPAC Name5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide
SMILESC[Si](C)(C)OC(c1ccccc1)c1cc(S(N)(=O)=O)cs1
InChIInChI=1S/C14H19NO3S2Si/c1-21(2,3)18-14(11-7-5-4-6-8-11)13-9-12(10-19-13)20(15,16)17/h4-10,14H,1-3H3,(H2,15,16,17)
InChIKeyCIBNKWBIZOWYGC-UHFFFAOYSA-N
XLogP3.34
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.53
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide?
The IUPAC name of 5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide (CID 10569266) is 5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide.
What is the SMILES notation for 5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide?
The canonical SMILES for 5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide is C[Si](C)(C)OC(c1ccccc1)c1cc(S(N)(=O)=O)cs1.
What is the InChIKey of 5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide?
The InChIKey is CIBNKWBIZOWYGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3S2Si/c1-21(2,3)18-14(11-7-5-4-6-8-11)13-9-12(10-19-13)20(15,16)17/h4-10,14H,1-3H3,(H2,15,16,17).
What are the key properties of 5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide?
5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide has a molecular weight of 341.53 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[phenyl(trimethylsilyloxy)methyl]thiophene-3-sulfonamide is sourced from PubChem (CID 10569266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).