trimethylsilyl N,N-dibutylcarbamate

C12H27NO2Si — CID 13183036

IUPACtrimethylsilyl N,N-dibutylcarbamate
SMILESCCCCN(CCCC)C(=O)O[Si](C)(C)C
InChIInChI=1S/C12H27NO2Si/c1-6-8-10-13(11-9-7-2)12(14)15-16(3,4)5/h6-11H2,1-5H3
InChIKeyAHYUHUOQPGWWLX-UHFFFAOYSA-N
MW245.44 g/mol
LogP3.86
Rot. Bonds7

About trimethylsilyl N,N-dibutylcarbamate

trimethylsilyl N,N-dibutylcarbamate (PubChem CID 13183036) has the molecular formula C12H27NO2Si and a molecular weight of 245.44 g/mol. Its IUPAC name is trimethylsilyl N,N-dibutylcarbamate.

Molecular Properties

Compound Nametrimethylsilyl N,N-dibutylcarbamate
PubChem CID13183036
Molecular FormulaC12H27NO2Si
Molecular Weight245.44 g/mol
Exact Mass245.18
IUPAC Nametrimethylsilyl N,N-dibutylcarbamate
SMILESCCCCN(CCCC)C(=O)O[Si](C)(C)C
InChIInChI=1S/C12H27NO2Si/c1-6-8-10-13(11-9-7-2)12(14)15-16(3,4)5/h6-11H2,1-5H3
InChIKeyAHYUHUOQPGWWLX-UHFFFAOYSA-N
XLogP3.86
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.44
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethyl N,N-didodecylcarbamate
CID 70629624
ethyl N-[6-[ethoxycarbonyl(octyl)amino]hexyl]-N-octylcarbamate
CID 23053337
ethyl N,N-di(heptadecyl)carbamate
CID 70629745
octyl N,N-di(nonyl)carbamate
CID 168918776
octyl N,N-di(undecyl)carbamate
CID 168918683
tert-butyl N,N-dipentylcarbamate
CID 65142743
propyl N,N-diheptylcarbamate
CID 168918832
2-(dibutylcarbamoyloxy)ethyl-triethylazanium
CID 24833385
tert-butyl N-butyl-N-(2-chloroethyl)carbamate
CID 114293365
chloromethyl N,N-di(pentadecyl)carbamate
CID 177225188
N,N-dibutylcarbamoyl chloride;hydrochloride
CID 141018315
calcium;N,N-dibutylcarbamothioate;carbamothioate
CID 118002498

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl N,N-dibutylcarbamate?
The IUPAC name of trimethylsilyl N,N-dibutylcarbamate (CID 13183036) is trimethylsilyl N,N-dibutylcarbamate.
What is the SMILES notation for trimethylsilyl N,N-dibutylcarbamate?
The canonical SMILES for trimethylsilyl N,N-dibutylcarbamate is CCCCN(CCCC)C(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl N,N-dibutylcarbamate?
The InChIKey is AHYUHUOQPGWWLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO2Si/c1-6-8-10-13(11-9-7-2)12(14)15-16(3,4)5/h6-11H2,1-5H3.
What are the key properties of trimethylsilyl N,N-dibutylcarbamate?
trimethylsilyl N,N-dibutylcarbamate has a molecular weight of 245.44 g/mol, XLogP of 3.86, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl N,N-dibutylcarbamate is sourced from PubChem (CID 13183036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).