ethyl N-propyl-N-triethoxysilylcarbamate

C12H27NO5Si — CID 54468213

IUPACethyl N-propyl-N-triethoxysilylcarbamate
SMILESCCCN(C(=O)OCC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H27NO5Si/c1-6-11-13(12(14)15-7-2)19(16-8-3,17-9-4)18-10-5/h6-11H2,1-5H3
InChIKeyXGLOEYJUDAVUKQ-UHFFFAOYSA-N
MW293.44 g/mol
LogP2.40
Rot. Bonds10

About ethyl N-propyl-N-triethoxysilylcarbamate

ethyl N-propyl-N-triethoxysilylcarbamate (PubChem CID 54468213) has the molecular formula C12H27NO5Si and a molecular weight of 293.44 g/mol. Its IUPAC name is ethyl N-propyl-N-triethoxysilylcarbamate.

Molecular Properties

Compound Nameethyl N-propyl-N-triethoxysilylcarbamate
PubChem CID54468213
Molecular FormulaC12H27NO5Si
Molecular Weight293.44 g/mol
Exact Mass293.17
IUPAC Nameethyl N-propyl-N-triethoxysilylcarbamate
SMILESCCCN(C(=O)OCC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H27NO5Si/c1-6-11-13(12(14)15-7-2)19(16-8-3,17-9-4)18-10-5/h6-11H2,1-5H3
InChIKeyXGLOEYJUDAVUKQ-UHFFFAOYSA-N
XLogP2.40
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.44
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(E)-2-[propyl(triethoxysilyl)amino]but-2-enedioic acid
CID 88513136
3-methyl-4-oxo-4-[propyl(triethoxysilyl)amino]butanoic acid
CID 87357004
prop-2-enyl N-propyl-N-tris(trimethylsilyloxy)silylcarbamate
CID 22412624
1-propyl-1-trimethoxysilylurea
CID 87287857
diethyl 2-[[ethoxy(dimethoxy)silyl]-propylamino]butanedioate
CID 87148864
ethyl N,N-diaminocarbamate
CID 54365685
ethyl N-[2-[ethoxycarbonyl(ethyl)amino]ethyl]-N-ethylcarbamate
CID 11777393
ethyl N-(cyclopropylmethyl)-N-propylcarbamate
CID 60637808
ethyl N,N-di(heptadecyl)carbamate
CID 70629745
ethyl N,N-didodecylcarbamate
CID 70629624
ethyl N-[6-[ethoxycarbonyl(octyl)amino]hexyl]-N-octylcarbamate
CID 23053337
ethyl N-[(Z)-but-2-enyl]-N-propylcarbamate
CID 143786345

Frequently Asked Questions

What is the IUPAC name of ethyl N-propyl-N-triethoxysilylcarbamate?
The IUPAC name of ethyl N-propyl-N-triethoxysilylcarbamate (CID 54468213) is ethyl N-propyl-N-triethoxysilylcarbamate.
What is the SMILES notation for ethyl N-propyl-N-triethoxysilylcarbamate?
The canonical SMILES for ethyl N-propyl-N-triethoxysilylcarbamate is CCCN(C(=O)OCC)[Si](OCC)(OCC)OCC.
What is the InChIKey of ethyl N-propyl-N-triethoxysilylcarbamate?
The InChIKey is XGLOEYJUDAVUKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO5Si/c1-6-11-13(12(14)15-7-2)19(16-8-3,17-9-4)18-10-5/h6-11H2,1-5H3.
What are the key properties of ethyl N-propyl-N-triethoxysilylcarbamate?
ethyl N-propyl-N-triethoxysilylcarbamate has a molecular weight of 293.44 g/mol, XLogP of 2.40, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-propyl-N-triethoxysilylcarbamate is sourced from PubChem (CID 54468213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).