2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine

C23H53NO4Si2 — CID 154406577

IUPAC2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine
SMILESCO[SiH2]CCCCCCOC(C)(C)CN(C)CC(C)(C)OCCCCCC[SiH2]OC
InChIInChI=1S/C23H53NO4Si2/c1-22(2,27-16-12-8-10-14-18-29-25-6)20-24(5)21-23(3,4)28-17-13-9-11-15-19-30-26-7/h8-21,29-30H2,1-7H3
InChIKeyGFUOZMALOAVIPY-UHFFFAOYSA-N
MW463.85 g/mol
LogP3.93
Rot. Bonds22

About 2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine

2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine (PubChem CID 154406577) has the molecular formula C23H53NO4Si2 and a molecular weight of 463.85 g/mol. Its IUPAC name is 2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound Name2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine
PubChem CID154406577
Molecular FormulaC23H53NO4Si2
Molecular Weight463.85 g/mol
Exact Mass463.35
IUPAC Name2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine
SMILESCO[SiH2]CCCCCCOC(C)(C)CN(C)CC(C)(C)OCCCCCC[SiH2]OC
InChIInChI=1S/C23H53NO4Si2/c1-22(2,27-16-12-8-10-14-18-29-25-6)20-24(5)21-23(3,4)28-17-13-9-11-15-19-30-26-7/h8-21,29-30H2,1-7H3
InChIKeyGFUOZMALOAVIPY-UHFFFAOYSA-N
XLogP3.93
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds22
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.85
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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

N-ethyl-2-(6-triethoxysilylhexoxy)-N-[2-(6-triethoxysilylhexoxy)ethyl]ethanamine
CID 141439928
N-methyl-2-(6-triethoxysilylhexoxy)-N-[2-(6-triethoxysilylhexoxy)ethyl]ethanamine
CID 141439937
N-ethyl-2-(6-trimethoxysilylhexoxy)-N-[2-(6-trimethoxysilylhexoxy)ethyl]ethanamine
CID 141439939
N-methyl-2-(6-trimethoxysilylhexoxy)-N-[2-(6-trimethoxysilylhexoxy)ethyl]ethanamine
CID 141439999
2-(3-methoxysilylpropoxy)-N-[2-(3-methoxysilylpropoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine
CID 154406541
N-ethyl-2-(3-methoxysilylpropoxy)-N-[2-(3-methoxysilylpropoxy)-2-methylpropyl]-2-methylpropan-1-amine
CID 154406543
2-(3-ethoxysilylpropoxy)-N-[2-(3-ethoxysilylpropoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine
CID 154406547
2-(3-ethoxysilylpropoxy)-N-[2-(3-ethoxysilylpropoxy)-2-methylpropyl]-N-ethyl-2-methylpropan-1-amine
CID 154406549
2-(4-dimethoxysilylbutoxy)-N-[2-(4-dimethoxysilylbutoxy)propyl]-N-methylpropan-1-amine
CID 154406552
2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine
CID 154406553
2-(4-dimethoxysilylbutoxy)-N-[2-(4-dimethoxysilylbutoxy)propyl]-N-ethylpropan-1-amine
CID 154406554
N-ethyl-2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-2-methylpropan-1-amine
CID 154406555

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine?
The IUPAC name of 2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine (CID 154406577) is 2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine.
What is the SMILES notation for 2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine?
The canonical SMILES for 2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine is CO[SiH2]CCCCCCOC(C)(C)CN(C)CC(C)(C)OCCCCCC[SiH2]OC.
What is the InChIKey of 2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine?
The InChIKey is GFUOZMALOAVIPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H53NO4Si2/c1-22(2,27-16-12-8-10-14-18-29-25-6)20-24(5)21-23(3,4)28-17-13-9-11-15-19-30-26-7/h8-21,29-30H2,1-7H3.
What are the key properties of 2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine?
2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine has a molecular weight of 463.85 g/mol, XLogP of 3.93, 22 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 154406577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).