4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine

C22H56N2O5Si5 — CID 154624355

IUPAC4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine
SMILESCC1(C)CC(OCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C)CC(C)(N)N1
InChIInChI=1S/C22H56N2O5Si5/c1-21(2)18-20(19-22(3,23)24-21)25-16-15-17-34(14,27-31(7,8)9)29-33(12,13)28-32(10,11)26-30(4,5)6/h20,24H,15-19,23H2,1-14H3
InChIKeyYHLHVFFPYVTUEV-UHFFFAOYSA-N
MW569.13 g/mol
LogP5.81
Rot. Bonds13

About 4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine

4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine (PubChem CID 154624355) has the molecular formula C22H56N2O5Si5 and a molecular weight of 569.13 g/mol. Its IUPAC name is 4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine.

Molecular Properties

Compound Name4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine
PubChem CID154624355
Molecular FormulaC22H56N2O5Si5
Molecular Weight569.13 g/mol
Exact Mass568.30
IUPAC Name4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine
SMILESCC1(C)CC(OCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C)CC(C)(N)N1
InChIInChI=1S/C22H56N2O5Si5/c1-21(2)18-20(19-22(3,23)24-21)25-16-15-17-34(14,27-31(7,8)9)29-33(12,13)28-32(10,11)26-30(4,5)6/h20,24H,15-19,23H2,1-14H3
InChIKeyYHLHVFFPYVTUEV-UHFFFAOYSA-N
XLogP5.81
TPSA84.20 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds13
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500569.13
LogP ≤ 55.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine?
The IUPAC name of 4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine (CID 154624355) is 4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine.
What is the SMILES notation for 4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine?
The canonical SMILES for 4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine is CC1(C)CC(OCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C)CC(C)(N)N1.
What is the InChIKey of 4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine?
The InChIKey is YHLHVFFPYVTUEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H56N2O5Si5/c1-21(2)18-20(19-22(3,23)24-21)25-16-15-17-34(14,27-31(7,8)9)29-33(12,13)28-32(10,11)26-30(4,5)6/h20,24H,15-19,23H2,1-14H3.
What are the key properties of 4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine?
4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine has a molecular weight of 569.13 g/mol, XLogP of 5.81, 13 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]-2,6,6-trimethylpiperidin-2-amine is sourced from PubChem (CID 154624355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).