3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine

C34H85N5O6Si5 — CID 171623500

IUPAC3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine
SMILESCCO[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)OCC
InChIInChI=1S/C34H85N5O6Si5/c1-18-40-46(13,30-20-25-35(3)4)42-48(15,32-22-27-37(7)8)44-50(17,34-24-29-39(11)12)45-49(16,33-23-28-38(9)10)43-47(14,41-19-2)31-21-26-36(5)6/h18-34H2,1-17H3
InChIKeyFHNDCXNCGQNXPH-UHFFFAOYSA-N
MW800.51 g/mol
LogP6.24
Rot. Bonds32

About 3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine

3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine (PubChem CID 171623500) has the molecular formula C34H85N5O6Si5 and a molecular weight of 800.51 g/mol. Its IUPAC name is 3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine
PubChem CID171623500
Molecular FormulaC34H85N5O6Si5
Molecular Weight800.51 g/mol
Exact Mass799.53
IUPAC Name3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine
SMILESCCO[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)OCC
InChIInChI=1S/C34H85N5O6Si5/c1-18-40-46(13,30-20-25-35(3)4)42-48(15,32-22-27-37(7)8)44-50(17,34-24-29-39(11)12)45-49(16,33-23-28-38(9)10)43-47(14,41-19-2)31-21-26-36(5)6/h18-34H2,1-17H3
InChIKeyFHNDCXNCGQNXPH-UHFFFAOYSA-N
XLogP6.24
TPSA71.58 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds32
Heavy Atoms50
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500800.51
LogP ≤ 56.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

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-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine (CID 171623500) is 3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine is CCO[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)O[Si](C)(CCCN(C)C)OCC.
What is the InChIKey of 3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine?
The InChIKey is FHNDCXNCGQNXPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H85N5O6Si5/c1-18-40-46(13,30-20-25-35(3)4)42-48(15,32-22-27-37(7)8)44-50(17,34-24-29-39(11)12)45-49(16,33-23-28-38(9)10)43-47(14,41-19-2)31-21-26-36(5)6/h18-34H2,1-17H3.
What are the key properties of 3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine?
3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine has a molecular weight of 800.51 g/mol, XLogP of 6.24, 32 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 171623500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).