benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate

C20H25NO3Si — CID 10594383

IUPACbenzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate
SMILESC[Si](C)(C)CN(CC(=O)c1ccccc1)C(=O)OCc1ccccc1
InChIInChI=1S/C20H25NO3Si/c1-25(2,3)16-21(14-19(22)18-12-8-5-9-13-18)20(23)24-15-17-10-6-4-7-11-17/h4-13H,14-16H2,1-3H3
InChIKeySHVKBXBAMWCPMA-UHFFFAOYSA-N
MW355.51 g/mol
LogP4.39
Rot. Bonds7

About benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate

benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate (PubChem CID 10594383) has the molecular formula C20H25NO3Si and a molecular weight of 355.51 g/mol. Its IUPAC name is benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate.

Molecular Properties

Compound Namebenzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate
PubChem CID10594383
Molecular FormulaC20H25NO3Si
Molecular Weight355.51 g/mol
Exact Mass355.16
IUPAC Namebenzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate
SMILESC[Si](C)(C)CN(CC(=O)c1ccccc1)C(=O)OCc1ccccc1
InChIInChI=1S/C20H25NO3Si/c1-25(2,3)16-21(14-19(22)18-12-8-5-9-13-18)20(23)24-15-17-10-6-4-7-11-17/h4-13H,14-16H2,1-3H3
InChIKeySHVKBXBAMWCPMA-UHFFFAOYSA-N
XLogP4.39
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.51
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate?
The IUPAC name of benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate (CID 10594383) is benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate.
What is the SMILES notation for benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate?
The canonical SMILES for benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate is C[Si](C)(C)CN(CC(=O)c1ccccc1)C(=O)OCc1ccccc1.
What is the InChIKey of benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate?
The InChIKey is SHVKBXBAMWCPMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3Si/c1-25(2,3)16-21(14-19(22)18-12-8-5-9-13-18)20(23)24-15-17-10-6-4-7-11-17/h4-13H,14-16H2,1-3H3.
What are the key properties of benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate?
benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate has a molecular weight of 355.51 g/mol, XLogP of 4.39, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-phenacyl-N-(trimethylsilylmethyl)carbamate is sourced from PubChem (CID 10594383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).