3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine

C24H44N2O3Si4 — CID 21365216

IUPAC3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine
SMILESC[Si](C)(CCCN)O[Si](C)(C)O[Si](O[Si](C)(C)CCCN)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H44N2O3Si4/c1-30(2,21-13-19-25)27-32(5,6)29-33(23-15-9-7-10-16-23,24-17-11-8-12-18-24)28-31(3,4)22-14-20-26/h7-12,15-18H,13-14,19-22,25-26H2,1-6H3
InChIKeyAWHPYTACPKQQLV-UHFFFAOYSA-N
MW520.97 g/mol
LogP4.10
Rot. Bonds14

About 3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine

3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine (PubChem CID 21365216) has the molecular formula C24H44N2O3Si4 and a molecular weight of 520.97 g/mol. Its IUPAC name is 3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine.

Molecular Properties

Compound Name3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine
PubChem CID21365216
Molecular FormulaC24H44N2O3Si4
Molecular Weight520.97 g/mol
Exact Mass520.24
IUPAC Name3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine
SMILESC[Si](C)(CCCN)O[Si](C)(C)O[Si](O[Si](C)(C)CCCN)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H44N2O3Si4/c1-30(2,21-13-19-25)27-32(5,6)29-33(23-15-9-7-10-16-23,24-17-11-8-12-18-24)28-31(3,4)22-14-20-26/h7-12,15-18H,13-14,19-22,25-26H2,1-6H3
InChIKeyAWHPYTACPKQQLV-UHFFFAOYSA-N
XLogP4.10
TPSA79.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500520.97
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine?
The IUPAC name of 3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine (CID 21365216) is 3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine.
What is the SMILES notation for 3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine?
The canonical SMILES for 3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine is C[Si](C)(CCCN)O[Si](C)(C)O[Si](O[Si](C)(C)CCCN)(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine?
The InChIKey is AWHPYTACPKQQLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H44N2O3Si4/c1-30(2,21-13-19-25)27-32(5,6)29-33(23-15-9-7-10-16-23,24-17-11-8-12-18-24)28-31(3,4)22-14-20-26/h7-12,15-18H,13-14,19-22,25-26H2,1-6H3.
What are the key properties of 3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine?
3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine has a molecular weight of 520.97 g/mol, XLogP of 4.10, 14 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[[[3-aminopropyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine is sourced from PubChem (CID 21365216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).