N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide

C19H33NO2Si — CID 139707583

IUPACN-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide
SMILESCN(Cc1ccccc1)C(=O)CCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H33NO2Si/c1-19(2,3)23(5,6)22-15-11-10-14-18(21)20(4)16-17-12-8-7-9-13-17/h7-9,12-13H,10-11,14-16H2,1-6H3
InChIKeyLKTKRURDEVUHCJ-UHFFFAOYSA-N
MW335.56 g/mol
LogP4.84
Rot. Bonds8

About N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide

N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide (PubChem CID 139707583) has the molecular formula C19H33NO2Si and a molecular weight of 335.56 g/mol. Its IUPAC name is N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide.

Molecular Properties

Compound NameN-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide
PubChem CID139707583
Molecular FormulaC19H33NO2Si
Molecular Weight335.56 g/mol
Exact Mass335.23
IUPAC NameN-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide
SMILESCN(Cc1ccccc1)C(=O)CCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H33NO2Si/c1-19(2,3)23(5,6)22-15-11-10-14-18(21)20(4)16-17-12-8-7-9-13-17/h7-9,12-13H,10-11,14-16H2,1-6H3
InChIKeyLKTKRURDEVUHCJ-UHFFFAOYSA-N
XLogP4.84
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.56
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

(E)-N-benzyl-3-methyl-5-triethoxysilylpent-3-enamide
CID 15965604
(3S,4R)-1-benzyl-3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-methylazetidin-2-one
CID 59089983
Glutaric acid, monoamide, N-methyl-N-benzyl-, isohexyl ester
CID 91710850
Glutaric acid, monoamide, N-methyl-N-benzyl-, hexyl ester
CID 91710851
Glutaric acid, monoamide, N-methyl-N-benzyl-, pentyl ester
CID 91710852
Glutaric acid, monoamide, N-methyl-N-benzyl-, pentadecyl ester
CID 91710853
Glutaric acid, monoamide, N-methyl-N-benzyl-, heptyl ester
CID 91710858
Glutaric acid, monoamide, N-methyl-N-benzyl-, octyl ester
CID 91710859
Glutaric acid, monoamide, N-methyl-N-benzyl-, nonyl ester
CID 91710860
Glutaric acid, monoamide, N-methyl-N-benzyl-, decyl ester
CID 91710861
Glutaric acid, monoamide, N-methyl-N-benzyl-, tetradecyl ester
CID 91710862
Glutaric acid, monoamide, N-methyl-N-benzyl-, ethyl ester
CID 91710863

Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide?
The IUPAC name of N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide (CID 139707583) is N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide.
What is the SMILES notation for N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide?
The canonical SMILES for N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide is CN(Cc1ccccc1)C(=O)CCCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide?
The InChIKey is LKTKRURDEVUHCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33NO2Si/c1-19(2,3)23(5,6)22-15-11-10-14-18(21)20(4)16-17-12-8-7-9-13-17/h7-9,12-13H,10-11,14-16H2,1-6H3.
What are the key properties of N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide?
N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide has a molecular weight of 335.56 g/mol, XLogP of 4.84, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-N-methylpentanamide is sourced from PubChem (CID 139707583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).