trimethylsilyl 10-benzamidodecanoate

C20H33NO3Si — CID 10808726

IUPACtrimethylsilyl 10-benzamidodecanoate
SMILESC[Si](C)(C)OC(=O)CCCCCCCCCNC(=O)c1ccccc1
InChIInChI=1S/C20H33NO3Si/c1-25(2,3)24-19(22)16-12-7-5-4-6-8-13-17-21-20(23)18-14-10-9-11-15-18/h9-11,14-15H,4-8,12-13,16-17H2,1-3H3,(H,21,23)
InChIKeyAAGLQGCMNNMZGW-UHFFFAOYSA-N
MW363.57 g/mol
LogP4.92
Rot. Bonds12

About trimethylsilyl 10-benzamidodecanoate

trimethylsilyl 10-benzamidodecanoate (PubChem CID 10808726) has the molecular formula C20H33NO3Si and a molecular weight of 363.57 g/mol. Its IUPAC name is trimethylsilyl 10-benzamidodecanoate.

Molecular Properties

Compound Nametrimethylsilyl 10-benzamidodecanoate
PubChem CID10808726
Molecular FormulaC20H33NO3Si
Molecular Weight363.57 g/mol
Exact Mass363.22
IUPAC Nametrimethylsilyl 10-benzamidodecanoate
SMILESC[Si](C)(C)OC(=O)CCCCCCCCCNC(=O)c1ccccc1
InChIInChI=1S/C20H33NO3Si/c1-25(2,3)24-19(22)16-12-7-5-4-6-8-13-17-21-20(23)18-14-10-9-11-15-18/h9-11,14-15H,4-8,12-13,16-17H2,1-3H3,(H,21,23)
InChIKeyAAGLQGCMNNMZGW-UHFFFAOYSA-N
XLogP4.92
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.57
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

trimethylsilyl 4-benzamidobutanoate
CID 10802651
trimethylsilyl 8-[(2-fluorobenzoyl)amino]octanoate
CID 10760551
methyl 4-benzamidobutanoate
CID 13197711
trimethylsilyl 4-[(2-methylbenzoyl)amino]butanoate
CID 10780080
N-[6-(2-methoxyethylamino)-6-oxohexyl]benzamide
CID 110839208
methyl 6-(pyridine-4-carbonylamino)hexanoate
CID 39070425
N-(6-hydrazinyl-6-oxohexyl)benzamide
CID 5226635
N-[5-[(2-sulfanylacetyl)amino]pentyl]benzamide
CID 11482903
methyl 7-[(3-phenoxybenzoyl)amino]heptanoate
CID 36622065
methyl 6-[(3-phenoxybenzoyl)amino]hexanoate
CID 31839416
N-[6-(5-hydroxypentylamino)-6-oxohexyl]benzamide
CID 110839273
methyl 7-[(4-acetylbenzoyl)amino]heptanoate
CID 163207825

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 10-benzamidodecanoate?
The IUPAC name of trimethylsilyl 10-benzamidodecanoate (CID 10808726) is trimethylsilyl 10-benzamidodecanoate.
What is the SMILES notation for trimethylsilyl 10-benzamidodecanoate?
The canonical SMILES for trimethylsilyl 10-benzamidodecanoate is C[Si](C)(C)OC(=O)CCCCCCCCCNC(=O)c1ccccc1.
What is the InChIKey of trimethylsilyl 10-benzamidodecanoate?
The InChIKey is AAGLQGCMNNMZGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33NO3Si/c1-25(2,3)24-19(22)16-12-7-5-4-6-8-13-17-21-20(23)18-14-10-9-11-15-18/h9-11,14-15H,4-8,12-13,16-17H2,1-3H3,(H,21,23).
What are the key properties of trimethylsilyl 10-benzamidodecanoate?
trimethylsilyl 10-benzamidodecanoate has a molecular weight of 363.57 g/mol, XLogP of 4.92, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 10-benzamidodecanoate is sourced from PubChem (CID 10808726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).