5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide

C10H22N2O6SSi — CID 168717350

IUPAC5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide
SMILESCO[Si](CCCN1CC(S(N)(=O)=O)CC1=O)(OC)OC
InChIInChI=1S/C10H22N2O6SSi/c1-16-20(17-2,18-3)6-4-5-12-8-9(7-10(12)13)19(11,14)15/h9H,4-8H2,1-3H3,(H2,11,14,15)
InChIKeyWMMPIQDSGPHDDR-UHFFFAOYSA-N
MW326.45 g/mol
LogP-0.86
Rot. Bonds8

About 5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide

5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide (PubChem CID 168717350) has the molecular formula C10H22N2O6SSi and a molecular weight of 326.45 g/mol. Its IUPAC name is 5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide.

Molecular Properties

Compound Name5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide
PubChem CID168717350
Molecular FormulaC10H22N2O6SSi
Molecular Weight326.45 g/mol
Exact Mass326.10
IUPAC Name5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide
SMILESCO[Si](CCCN1CC(S(N)(=O)=O)CC1=O)(OC)OC
InChIInChI=1S/C10H22N2O6SSi/c1-16-20(17-2,18-3)6-4-5-12-8-9(7-10(12)13)19(11,14)15/h9H,4-8H2,1-3H3,(H2,11,14,15)
InChIKeyWMMPIQDSGPHDDR-UHFFFAOYSA-N
XLogP-0.86
TPSA108.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.45
LogP ≤ 5-0.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-(3-methylsulfanylpropyl)-5-oxopyrrolidine-3-sulfonamide
CID 168717537
1-[3-[dimethoxy(methyl)silyl]propyl]-5-oxopyrrolidine-3-sulfonyl fluoride
CID 168714021
1-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-5-oxopyrrolidine-3-sulfonamide
CID 168718184
1-[3-(azepan-1-yl)propyl]-5-oxopyrrolidine-3-sulfonamide
CID 168718145
1-(3,3-diethoxypropyl)-5-oxopyrrolidine-3-sulfonamide
CID 168717057
S-[5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidin-3-yl] ethanethioate
CID 168705187
5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide
CID 168718283
1-(3-methoxypropyl)-5-oxopyrrolidine-3-sulfonyl chloride
CID 168711428
5-oxo-1-prop-2-ynylpyrrolidine-3-sulfonamide
CID 168716757
N,N-dimethyl-2-(2-oxo-4-sulfamoylpyrrolidin-1-yl)acetamide
CID 168717165
1-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-5-oxopyrrolidine-3-sulfonamide
CID 168716563
methyl 5-oxo-1-(3-triethoxysilylpropyl)pyrrolidine-3-carboxylate
CID 3023550

Frequently Asked Questions

What is the IUPAC name of 5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide?
The IUPAC name of 5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide (CID 168717350) is 5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide.
What is the SMILES notation for 5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide?
The canonical SMILES for 5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide is CO[Si](CCCN1CC(S(N)(=O)=O)CC1=O)(OC)OC.
What is the InChIKey of 5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide?
The InChIKey is WMMPIQDSGPHDDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O6SSi/c1-16-20(17-2,18-3)6-4-5-12-8-9(7-10(12)13)19(11,14)15/h9H,4-8H2,1-3H3,(H2,11,14,15).
What are the key properties of 5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide?
5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide has a molecular weight of 326.45 g/mol, XLogP of -0.86, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide is sourced from PubChem (CID 168717350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).