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

C18H52N2O5Si6 — CID 18354066

IUPAC3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine
SMILESC[Si](C)(CCCN)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCN
InChIInChI=1S/C18H52N2O5Si6/c1-26(2,17-13-15-19)21-28(5,6)23-30(9,10)25-31(11,12)24-29(7,8)22-27(3,4)18-14-16-20/h13-20H2,1-12H3
InChIKeyBHDGJUQHKLJUKQ-UHFFFAOYSA-N
MW545.14 g/mol
LogP4.98
Rot. Bonds16

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

3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine (PubChem CID 18354066) has the molecular formula C18H52N2O5Si6 and a molecular weight of 545.14 g/mol. Its IUPAC name is 3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine.

Molecular Properties

Compound Name3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine
PubChem CID18354066
Molecular FormulaC18H52N2O5Si6
Molecular Weight545.14 g/mol
Exact Mass544.25
IUPAC Name3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine
SMILESC[Si](C)(CCCN)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCN
InChIInChI=1S/C18H52N2O5Si6/c1-26(2,17-13-15-19)21-28(5,6)23-30(9,10)25-31(11,12)24-29(7,8)22-27(3,4)18-14-16-20/h13-20H2,1-12H3
InChIKeyBHDGJUQHKLJUKQ-UHFFFAOYSA-N
XLogP4.98
TPSA98.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500545.14
LogP ≤ 54.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine?
The IUPAC name of 3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine (CID 18354066) is 3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine.
What is the SMILES notation for 3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine?
The canonical SMILES for 3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine is C[Si](C)(CCCN)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCN.
What is the InChIKey of 3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine?
The InChIKey is BHDGJUQHKLJUKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H52N2O5Si6/c1-26(2,17-13-15-19)21-28(5,6)23-30(9,10)25-31(11,12)24-29(7,8)22-27(3,4)18-14-16-20/h13-20H2,1-12H3.
What are the key properties of 3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine?
3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine has a molecular weight of 545.14 g/mol, XLogP of 4.98, 16 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine is sourced from PubChem (CID 18354066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).