N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide

C15H25NO3Si — CID 10946366

IUPACN-benzyl-4-methoxy-3-trimethylsilyloxybutanamide
SMILESCOCC(CC(=O)NCc1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C15H25NO3Si/c1-18-12-14(19-20(2,3)4)10-15(17)16-11-13-8-6-5-7-9-13/h5-9,14H,10-12H2,1-4H3,(H,16,17)
InChIKeyZKOYQXYENCRVOP-UHFFFAOYSA-N
MW295.45 g/mol
LogP2.56
Rot. Bonds8

About N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide

N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide (PubChem CID 10946366) has the molecular formula C15H25NO3Si and a molecular weight of 295.45 g/mol. Its IUPAC name is N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide.

Molecular Properties

Compound NameN-benzyl-4-methoxy-3-trimethylsilyloxybutanamide
PubChem CID10946366
Molecular FormulaC15H25NO3Si
Molecular Weight295.45 g/mol
Exact Mass295.16
IUPAC NameN-benzyl-4-methoxy-3-trimethylsilyloxybutanamide
SMILESCOCC(CC(=O)NCc1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C15H25NO3Si/c1-18-12-14(19-20(2,3)4)10-15(17)16-11-13-8-6-5-7-9-13/h5-9,14H,10-12H2,1-4H3,(H,16,17)
InChIKeyZKOYQXYENCRVOP-UHFFFAOYSA-N
XLogP2.56
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(E)-N-benzyl-3-methyl-5-triethoxysilylpent-3-enamide
CID 15965604
N-benzyl-3-trimethylsilyloxybutanamide
CID 135070164
N-benzyl 3-methoxypropionamide
CID 59651317
(3R)-N-benzyl-3-hydroxypentanamide
CID 130658384
N-[(4-fluorophenyl)methyl]-2-(methoxymethyl)butanediamide
CID 57107537
N-[(3-fluorophenyl)methyl]-2-(methoxymethyl)butanediamide
CID 57133845
(2R)-N-[(3-fluorophenyl)methyl]-2-(methoxymethyl)butanediamide
CID 69904852
(2R)-N-[(4-fluorophenyl)methyl]-2-(methoxymethyl)butanediamide
CID 69905192
(2R)-N-[(4-fluorophenyl)methyl]-2-(methoxymethyl)-3-methylbutanamide
CID 172173787
(3R)-N-benzyl-3-hydroxybutanamide
CID 10921388
Methyl 2-[(benzylamino)methyl]-3-[tert-butyl(dimethyl)silyl]oxybutanoate
CID 13943725
N-benzyl-4-trimethylsilyloxybutanamide
CID 10901523

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide?
The IUPAC name of N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide (CID 10946366) is N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide.
What is the SMILES notation for N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide?
The canonical SMILES for N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide is COCC(CC(=O)NCc1ccccc1)O[Si](C)(C)C.
What is the InChIKey of N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide?
The InChIKey is ZKOYQXYENCRVOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3Si/c1-18-12-14(19-20(2,3)4)10-15(17)16-11-13-8-6-5-7-9-13/h5-9,14H,10-12H2,1-4H3,(H,16,17).
What are the key properties of N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide?
N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide has a molecular weight of 295.45 g/mol, XLogP of 2.56, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-methoxy-3-trimethylsilyloxybutanamide is sourced from PubChem (CID 10946366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).