N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide

C25H41NO3Si3 — CID 20652817

IUPACN-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide
SMILESCCC(C)C(=O)NCCC[Si](C)(C)O[Si](O[Si](C)(C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H41NO3Si3/c1-8-22(2)25(27)26-20-15-21-31(6,7)29-32(28-30(3,4)5,23-16-11-9-12-17-23)24-18-13-10-14-19-24/h9-14,16-19,22H,8,15,20-21H2,1-7H3,(H,26,27)
InChIKeyUCTLUGLWPQVFLN-UHFFFAOYSA-N
MW487.87 g/mol
LogP4.87
Rot. Bonds12

About N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide

N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide (PubChem CID 20652817) has the molecular formula C25H41NO3Si3 and a molecular weight of 487.87 g/mol. Its IUPAC name is N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide.

Molecular Properties

Compound NameN-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide
PubChem CID20652817
Molecular FormulaC25H41NO3Si3
Molecular Weight487.87 g/mol
Exact Mass487.24
IUPAC NameN-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide
SMILESCCC(C)C(=O)NCCC[Si](C)(C)O[Si](O[Si](C)(C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H41NO3Si3/c1-8-22(2)25(27)26-20-15-21-31(6,7)29-32(28-30(3,4)5,23-16-11-9-12-17-23)24-18-13-10-14-19-24/h9-14,16-19,22H,8,15,20-21H2,1-7H3,(H,26,27)
InChIKeyUCTLUGLWPQVFLN-UHFFFAOYSA-N
XLogP4.87
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500487.87
LogP ≤ 54.87
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

(2R)-2-methyl-N-(3-phenylpropyl)butanamide
CID 94018072
bis(dimethylsilyloxy)-[2-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy-phenylsilane
CID 123894603
2-methyl-N-[3-[4-(2-phenylethynyl)phenoxy]propyl]butanamide
CID 22976427
N-[3-[[dimethyl-[3-(3-phenylprop-2-enoylamino)propyl]silyl]oxy-dimethylsilyl]propyl]-3-phenylprop-2-enamide
CID 76676980
2-[3-[methyl(diphenoxy)silyl]propylcarbamoylamino]ethyl 2-methylbutanoate
CID 59439700
N-butyl-2-methyl-3-phenylpropanamide
CID 70830385
2-methyl-N-[2-(4-phenoxyphenyl)ethyl]butanamide
CID 126657315
N-[3-[[3-acetamidopropyl(dimethyl)silyl]oxy-dimethylsilyl]propyl]acetamide;3-[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]propan-1-amine;N-[3-[chloro(dimethyl)silyl]propyl]acetamide;N-[3-[[dimethyl(phenyl)silyl]oxy-dimethylsilyl]propyl]acetamide;hydroxy-dimethyl-phenylsilane
CID 159412264
2-methyl-N-(3-tripropoxysilylpropyl)butanamide
CID 58520012
[4-[[dimethyl-[3-(2-methylbutanoylamino)propyl]azaniumyl]methyl]phenyl]methyl-dimethyl-[3-(2-methylbutanoylamino)propyl]azanium
CID 121423164
bis[[methyl(diphenyl)silyl]oxy]-diphenylsilane
CID 19905828
N-[3-[[[dimethyl-[3-[(2,3,5-trihydroxy-4-methylheptanoyl)amino]propyl]silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propyl]-2,3,5-trihydroxy-4-methylheptanamide
CID 58399715

Frequently Asked Questions

What is the IUPAC name of N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide?
The IUPAC name of N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide (CID 20652817) is N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide.
What is the SMILES notation for N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide?
The canonical SMILES for N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide is CCC(C)C(=O)NCCC[Si](C)(C)O[Si](O[Si](C)(C)C)(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide?
The InChIKey is UCTLUGLWPQVFLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H41NO3Si3/c1-8-22(2)25(27)26-20-15-21-31(6,7)29-32(28-30(3,4)5,23-16-11-9-12-17-23)24-18-13-10-14-19-24/h9-14,16-19,22H,8,15,20-21H2,1-7H3,(H,26,27).
What are the key properties of N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide?
N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide has a molecular weight of 487.87 g/mol, XLogP of 4.87, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[diphenyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]-2-methylbutanamide is sourced from PubChem (CID 20652817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).