N,N-dibenzyl-4-trimethylsilylbutanamide

C21H29NOSi — CID 16744462

IUPACN,N-dibenzyl-4-trimethylsilylbutanamide
SMILESC[Si](C)(C)CCCC(=O)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H29NOSi/c1-24(2,3)16-10-15-21(23)22(17-19-11-6-4-7-12-19)18-20-13-8-5-9-14-20/h4-9,11-14H,10,15-18H2,1-3H3
InChIKeyWQWBYZBVSVFFQV-UHFFFAOYSA-N
MW339.56 g/mol
LogP5.33
Rot. Bonds8

About N,N-dibenzyl-4-trimethylsilylbutanamide

N,N-dibenzyl-4-trimethylsilylbutanamide (PubChem CID 16744462) has the molecular formula C21H29NOSi and a molecular weight of 339.56 g/mol. Its IUPAC name is N,N-dibenzyl-4-trimethylsilylbutanamide.

Molecular Properties

Compound NameN,N-dibenzyl-4-trimethylsilylbutanamide
PubChem CID16744462
Molecular FormulaC21H29NOSi
Molecular Weight339.56 g/mol
Exact Mass339.20
IUPAC NameN,N-dibenzyl-4-trimethylsilylbutanamide
SMILESC[Si](C)(C)CCCC(=O)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H29NOSi/c1-24(2,3)16-10-15-21(23)22(17-19-11-6-4-7-12-19)18-20-13-8-5-9-14-20/h4-9,11-14H,10,15-18H2,1-3H3
InChIKeyWQWBYZBVSVFFQV-UHFFFAOYSA-N
XLogP5.33
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.56
LogP ≤ 55.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N'-dibenzyl-N,N'-diethylpentanediamide
CID 68902262
N-benzyl-N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide
CID 79200837
N',N'-dibenzylbutanediamide
CID 101024490
6-[benzyl(propyl)amino]-6-oxohexanoic acid
CID 43579947
N-benzyl-5-chloro-N-ethylpentanamide
CID 28727812
N-benzyl-N-(2-phenylethyl)pentanamide
CID 112791262
3-[benzyl(pentanoyl)amino]propanoic acid
CID 82323494
2-amino-5-(dibenzylamino)-5-oxopentanoic acid
CID 69304908
N,N'-bis(3-amino-3-oxopropyl)-N,N'-dibenzylhexanediamide
CID 28642999
N-benzyl-5-hydroxy-N-(2-hydroxyethyl)pentanamide
CID 79191990
4-amino-N-benzyl-N-propylbutanamide
CID 43588666
N-benzyl-N-butyl-4-hydroxybutanamide
CID 139706995

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-4-trimethylsilylbutanamide?
The IUPAC name of N,N-dibenzyl-4-trimethylsilylbutanamide (CID 16744462) is N,N-dibenzyl-4-trimethylsilylbutanamide.
What is the SMILES notation for N,N-dibenzyl-4-trimethylsilylbutanamide?
The canonical SMILES for N,N-dibenzyl-4-trimethylsilylbutanamide is C[Si](C)(C)CCCC(=O)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzyl-4-trimethylsilylbutanamide?
The InChIKey is WQWBYZBVSVFFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29NOSi/c1-24(2,3)16-10-15-21(23)22(17-19-11-6-4-7-12-19)18-20-13-8-5-9-14-20/h4-9,11-14H,10,15-18H2,1-3H3.
What are the key properties of N,N-dibenzyl-4-trimethylsilylbutanamide?
N,N-dibenzyl-4-trimethylsilylbutanamide has a molecular weight of 339.56 g/mol, XLogP of 5.33, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-4-trimethylsilylbutanamide is sourced from PubChem (CID 16744462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).