N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline

C92H146N8O17Si8 — CID 171623543

IUPACN-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline
SMILESCCO[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)OCC
InChIInChI=1S/C92H146N8O17Si8/c1-11-101-118(102-12-2,77-45-69-93-85-53-29-21-30-54-85)111-120(105-15-5,79-47-71-95-87-57-33-23-34-58-87)113-122(107-17-7,81-49-73-97-89-61-37-25-38-62-89)115-124(109-19-9,83-51-75-99-91-65-41-27-42-66-91)117-125(110-20-10,84-52-76-100-92-67-43-28-44-68-92)116-123(108-18-8,82-50-74-98-90-63-39-26-40-64-90)114-121(106-16-6,80-48-72-96-88-59-35-24-36-60-88)112-119(103-13-3,104-14-4)78-46-70-94-86-55-31-22-32-56-86/h21-44,53-68,93-100H,11-20,45-52,69-84H2,1-10H3
InChIKeyCSPSUTXOFJZGSB-UHFFFAOYSA-N
MW1860.91 g/mol
LogP21.00
Rot. Bonds74

About N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline

N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline (PubChem CID 171623543) has the molecular formula C92H146N8O17Si8 and a molecular weight of 1860.91 g/mol. Its IUPAC name is N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline.

Molecular Properties

Compound NameN-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline
PubChem CID171623543
Molecular FormulaC92H146N8O17Si8
Molecular Weight1860.91 g/mol
Exact Mass1858.90
IUPAC NameN-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline
SMILESCCO[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)OCC
InChIInChI=1S/C92H146N8O17Si8/c1-11-101-118(102-12-2,77-45-69-93-85-53-29-21-30-54-85)111-120(105-15-5,79-47-71-95-87-57-33-23-34-58-87)113-122(107-17-7,81-49-73-97-89-61-37-25-38-62-89)115-124(109-19-9,83-51-75-99-91-65-41-27-42-66-91)117-125(110-20-10,84-52-76-100-92-67-43-28-44-68-92)116-123(108-18-8,82-50-74-98-90-63-39-26-40-64-90)114-121(106-16-6,80-48-72-96-88-59-35-24-36-60-88)112-119(103-13-3,104-14-4)78-46-70-94-86-55-31-22-32-56-86/h21-44,53-68,93-100H,11-20,45-52,69-84H2,1-10H3
InChIKeyCSPSUTXOFJZGSB-UHFFFAOYSA-N
XLogP21.00
TPSA253.15 Ų
H-Bond Donors8
H-Bond Acceptors25
Rotatable Bonds74
Heavy Atoms125
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001860.91
LogP ≤ 521.00
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

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

Analyze N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline with MolForge

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Related Compounds

N-[3-(3-triethoxysilylpropylsulfanyl)propyl]aniline
CID 175770295
CID 165388786
CID 165388786
triethoxy(3-isocyanatopropyl)silane;N-(3-trimethoxysilylpropyl)aniline
CID 159457965
N-[4-[3-anilinopropyl(dimethoxy)silyl]oxybutyl]aniline
CID 151955793
N-[3-[[diethoxy-[3-(3-triethoxysilylpropylamino)propyl]silyl]oxy-diethoxysilyl]propyl]-3-triethoxysilylpropan-1-amine
CID 171623585
N-(3-trihydroxysilylpropyl)aniline
CID 140901816
N-[3-[[diethoxy-[3-(N-trimethylsilylanilino)propyl]silyl]oxy-diethoxysilyl]propyl]-N-trimethylsilylaniline;N-trimethylsilylaniline
CID 158236338
N-(4-trimethylsilylbutyl)aniline
CID 172713134
N-[4-[ethoxy(diethyl)silyl]oxypentyl]aniline
CID 175181392
N-(12-ethoxydodecyl)aniline
CID 54545171
N-phenyl-4-triethoxysilylbutanamide
CID 150591248
1-phenyl-N-(3-triethoxysilylpropyl)methanesulfonamide
CID 68511239

Frequently Asked Questions

What is the IUPAC name of N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline?
The IUPAC name of N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline (CID 171623543) is N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline.
What is the SMILES notation for N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline?
The canonical SMILES for N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline is CCO[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)O[Si](CCCNc1ccccc1)(OCC)OCC.
What is the InChIKey of N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline?
The InChIKey is CSPSUTXOFJZGSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C92H146N8O17Si8/c1-11-101-118(102-12-2,77-45-69-93-85-53-29-21-30-54-85)111-120(105-15-5,79-47-71-95-87-57-33-23-34-58-87)113-122(107-17-7,81-49-73-97-89-61-37-25-38-62-89)115-124(109-19-9,83-51-75-99-91-65-41-27-42-66-91)117-125(110-20-10,84-52-76-100-92-67-43-28-44-68-92)116-123(108-18-8,82-50-74-98-90-63-39-26-40-64-90)114-121(106-16-6,80-48-72-96-88-59-35-24-36-60-88)112-119(103-13-3,104-14-4)78-46-70-94-86-55-31-22-32-56-86/h21-44,53-68,93-100H,11-20,45-52,69-84H2,1-10H3.
What are the key properties of N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline?
N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline has a molecular weight of 1860.91 g/mol, XLogP of 21.00, 74 rotatable bonds, 8 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl-[3-anilinopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propyl]aniline is sourced from PubChem (CID 171623543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).