4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine

C32H40N2OSi2 — CID 20608300

IUPAC4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine
SMILESNCCCC[Si](OC[Si](CCCN)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H40N2OSi2/c33-24-13-14-27-37(31-20-9-3-10-21-31,32-22-11-4-12-23-32)35-28-36(26-15-25-34,29-16-5-1-6-17-29)30-18-7-2-8-19-30/h1-12,16-23H,13-15,24-28,33-34H2
InChIKeyPBAWOJOMPHEFLY-UHFFFAOYSA-N
MW524.86 g/mol
LogP3.65
Rot. Bonds14

About 4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine

4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine (PubChem CID 20608300) has the molecular formula C32H40N2OSi2 and a molecular weight of 524.86 g/mol. Its IUPAC name is 4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine.

Molecular Properties

Compound Name4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine
PubChem CID20608300
Molecular FormulaC32H40N2OSi2
Molecular Weight524.86 g/mol
Exact Mass524.27
IUPAC Name4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine
SMILESNCCCC[Si](OC[Si](CCCN)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H40N2OSi2/c33-24-13-14-27-37(31-20-9-3-10-21-31,32-22-11-4-12-23-32)35-28-36(26-15-25-34,29-16-5-1-6-17-29)30-18-7-2-8-19-30/h1-12,16-23H,13-15,24-28,33-34H2
InChIKeyPBAWOJOMPHEFLY-UHFFFAOYSA-N
XLogP3.65
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500524.86
LogP ≤ 53.65
H-Bond Donors ≤ 52
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

3,3'-(3,3-Diphenyl-1,1,5,5-tetramethoxytrisiloxane-1,5-diyl)bis-(propan-1-amine)
CID 176469666
1,5-Di(ethylamino)-dekaphenylpentasilan
CID 12634680
2-[[2-Aminoethyl(diphenyl)silyl]oxy-diphenylsilyl]ethanamine
CID 19089646
4-[(3-Aminopropyl-methyl-phenylsilyl)methoxy-methyl-phenylsilyl]butan-1-amine
CID 20608301
3-[(3-Aminopropyl-methyl-phenylsilyl)oxy-methyl-phenylsilyl]propan-1-amine
CID 21285292
3-[[[[3-Aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine
CID 21365216
3-[[[3-Aminopropyl(diphenyl)silyl]oxy-dimethylsilyl]oxy-diphenylsilyl]propan-1-amine
CID 21739277
Bis[4-aminobutyl(diphenyl)silyl] dimethyl silicate
CID 21739278
Bis[5-aminopentyl(diphenyl)silyl] dimethyl silicate
CID 21739280
Bis[1-aminobutyl(diphenyl)silyl] dimethyl silicate
CID 21744020
1-(1-Aminopropyl-phenyl-triphenylsilyloxysilyl)propan-1-amine
CID 21989018
2-(t-Butyldiphenylsilyloxy)-1-(t-butyldiphenylsilyloxymethyl)ethylamine
CID 22242907

Frequently Asked Questions

What is the IUPAC name of 4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine?
The IUPAC name of 4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine (CID 20608300) is 4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine.
What is the SMILES notation for 4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine?
The canonical SMILES for 4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine is NCCCC[Si](OC[Si](CCCN)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine?
The InChIKey is PBAWOJOMPHEFLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H40N2OSi2/c33-24-13-14-27-37(31-20-9-3-10-21-31,32-22-11-4-12-23-32)35-28-36(26-15-25-34,29-16-5-1-6-17-29)30-18-7-2-8-19-30/h1-12,16-23H,13-15,24-28,33-34H2.
What are the key properties of 4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine?
4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine has a molecular weight of 524.86 g/mol, XLogP of 3.65, 14 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-aminopropyl(diphenyl)silyl]methoxy-diphenylsilyl]butan-1-amine is sourced from PubChem (CID 20608300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).