ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate

C13H31NO4Si3 — CID 87161549

IUPACethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate
SMILESC=COC(=O)NCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C13H31NO4Si3/c1-9-16-13(15)14-11-10-12-21(8,17-19(2,3)4)18-20(5,6)7/h9H,1,10-12H2,2-8H3,(H,14,15)
InChIKeyMAGNPUXIOMIVNV-UHFFFAOYSA-N
MW349.65 g/mol
LogP4.02
Rot. Bonds9

About ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate

ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate (PubChem CID 87161549) has the molecular formula C13H31NO4Si3 and a molecular weight of 349.65 g/mol. Its IUPAC name is ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate.

Molecular Properties

Compound Nameethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate
PubChem CID87161549
Molecular FormulaC13H31NO4Si3
Molecular Weight349.65 g/mol
Exact Mass349.16
IUPAC Nameethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate
SMILESC=COC(=O)NCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C13H31NO4Si3/c1-9-16-13(15)14-11-10-12-21(8,17-19(2,3)4)18-20(5,6)7/h9H,1,10-12H2,2-8H3,(H,14,15)
InChIKeyMAGNPUXIOMIVNV-UHFFFAOYSA-N
XLogP4.02
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.65
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate?
The IUPAC name of ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate (CID 87161549) is ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate.
What is the SMILES notation for ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate?
The canonical SMILES for ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate is C=COC(=O)NCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate?
The InChIKey is MAGNPUXIOMIVNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H31NO4Si3/c1-9-16-13(15)14-11-10-12-21(8,17-19(2,3)4)18-20(5,6)7/h9H,1,10-12H2,2-8H3,(H,14,15).
What are the key properties of ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate?
ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate has a molecular weight of 349.65 g/mol, XLogP of 4.02, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl N-[3-[methyl-bis(trimethylsilyloxy)silyl]propyl]carbamate is sourced from PubChem (CID 87161549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).