2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine

C19H45NO4Si2 — CID 154406553

IUPAC2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine
SMILESCO[SiH2]CCCCOC(C)(C)CN(C)CC(C)(C)OCCCC[SiH2]OC
InChIInChI=1S/C19H45NO4Si2/c1-18(2,23-12-8-10-14-25-21-6)16-20(5)17-19(3,4)24-13-9-11-15-26-22-7/h8-17,25-26H2,1-7H3
InChIKeyWOQAYKFIONXXQE-UHFFFAOYSA-N
MW407.74 g/mol
LogP2.37
Rot. Bonds18

About 2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine

2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine (PubChem CID 154406553) has the molecular formula C19H45NO4Si2 and a molecular weight of 407.74 g/mol. Its IUPAC name is 2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound Name2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine
PubChem CID154406553
Molecular FormulaC19H45NO4Si2
Molecular Weight407.74 g/mol
Exact Mass407.29
IUPAC Name2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine
SMILESCO[SiH2]CCCCOC(C)(C)CN(C)CC(C)(C)OCCCC[SiH2]OC
InChIInChI=1S/C19H45NO4Si2/c1-18(2,23-12-8-10-14-25-21-6)16-20(5)17-19(3,4)24-13-9-11-15-26-22-7/h8-17,25-26H2,1-7H3
InChIKeyWOQAYKFIONXXQE-UHFFFAOYSA-N
XLogP2.37
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds18
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.74
LogP ≤ 52.37
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'}

Analyze 2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine with MolForge

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Related Compounds

2-(6-methoxysilylhexoxy)-N-[2-(6-methoxysilylhexoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine
CID 154406577
methoxy(2-methoxysilylethyl)silane
CID 71401369
1,10-bis(2-methylbutan-2-yloxy)decane
CID 171725385
2-[[2-(2-aminoethoxy)-2-methylpropyl]-methylamino]ethanol
CID 87792104
2-(3-ethoxysilylpropoxy)-N-[2-(3-ethoxysilylpropoxy)-2-methylpropyl]-2-methylpropan-1-amine
CID 154406545
6-methoxysilylhexyl prop-2-enoate
CID 150247885
1-(2-methylbutan-2-yloxy)tetradecane
CID 86191698
[methyl-[3-(2-methylpentan-2-yloxy)propyl]amino] hypoiodite
CID 155468015
2-dodecoxy-2-methyltetradecane
CID 158074564
3-methoxysilylpropane-1,1,1-trithiol
CID 123262087
methoxy(3,3,3-trifluoropropyl)silane
CID 123372538
2-chloroethyl(methoxy)silane
CID 154337921

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine?
The IUPAC name of 2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine (CID 154406553) is 2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine.
What is the SMILES notation for 2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine?
The canonical SMILES for 2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine is CO[SiH2]CCCCOC(C)(C)CN(C)CC(C)(C)OCCCC[SiH2]OC.
What is the InChIKey of 2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine?
The InChIKey is WOQAYKFIONXXQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H45NO4Si2/c1-18(2,23-12-8-10-14-25-21-6)16-20(5)17-19(3,4)24-13-9-11-15-26-22-7/h8-17,25-26H2,1-7H3.
What are the key properties of 2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine?
2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine has a molecular weight of 407.74 g/mol, XLogP of 2.37, 18 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxysilylbutoxy)-N-[2-(4-methoxysilylbutoxy)-2-methylpropyl]-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 154406553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).