N-benzyl-3-trimethylsilyloxybutanamide

C14H23NO2Si — CID 135070164

IUPACN-benzyl-3-trimethylsilyloxybutanamide
SMILESCC(CC(=O)NCc1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C14H23NO2Si/c1-12(17-18(2,3)4)10-14(16)15-11-13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H,15,16)
InChIKeyYSECVKYAQKZNSA-UHFFFAOYSA-N
MW265.43 g/mol
LogP2.93
Rot. Bonds6

About N-benzyl-3-trimethylsilyloxybutanamide

N-benzyl-3-trimethylsilyloxybutanamide (PubChem CID 135070164) has the molecular formula C14H23NO2Si and a molecular weight of 265.43 g/mol. Its IUPAC name is N-benzyl-3-trimethylsilyloxybutanamide.

Molecular Properties

Compound NameN-benzyl-3-trimethylsilyloxybutanamide
PubChem CID135070164
Molecular FormulaC14H23NO2Si
Molecular Weight265.43 g/mol
Exact Mass265.15
IUPAC NameN-benzyl-3-trimethylsilyloxybutanamide
SMILESCC(CC(=O)NCc1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C14H23NO2Si/c1-12(17-18(2,3)4)10-14(16)15-11-13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H,15,16)
InChIKeyYSECVKYAQKZNSA-UHFFFAOYSA-N
XLogP2.93
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.43
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 70159
N-Benzyl-butyramide
CID 221807
n-Benzylhexanamide
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2-Methyl-N-(phenylmethyl)butanamide
CID 4475689
(2S)-N-benzyl-2-methylbutanamide
CID 56672539
3-hydroxy-N-phenethyl-butyramide
CID 69602938
Butanamide, 4-((1-oxobutyl)amino)-N-(phenylmethyl)-
CID 3067793
N-benzyl-2-propylpentanamide
CID 3032168
N-benzyl-2-[ditert-butyl(fluoro)silyl]acetamide
CID 72704094
N-benzyl-3-[ditert-butyl(fluoro)silyl]propanamide
CID 72704095
N-benzyl-2-ethylbutanamide
CID 835620
N-benzyl-2-methylpentanamide
CID 2888908

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-trimethylsilyloxybutanamide?
The IUPAC name of N-benzyl-3-trimethylsilyloxybutanamide (CID 135070164) is N-benzyl-3-trimethylsilyloxybutanamide.
What is the SMILES notation for N-benzyl-3-trimethylsilyloxybutanamide?
The canonical SMILES for N-benzyl-3-trimethylsilyloxybutanamide is CC(CC(=O)NCc1ccccc1)O[Si](C)(C)C.
What is the InChIKey of N-benzyl-3-trimethylsilyloxybutanamide?
The InChIKey is YSECVKYAQKZNSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2Si/c1-12(17-18(2,3)4)10-14(16)15-11-13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H,15,16).
What are the key properties of N-benzyl-3-trimethylsilyloxybutanamide?
N-benzyl-3-trimethylsilyloxybutanamide has a molecular weight of 265.43 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-trimethylsilyloxybutanamide is sourced from PubChem (CID 135070164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).