tripropyl(1-trimethoxysilylpropyl)azanium hydroxide

C15H37NO4Si — CID 87513848

IUPACtripropyl(1-trimethoxysilylpropyl)azanium hydroxide
SMILESCCC[N+](CCC)(CCC)C(CC)[Si](OC)(OC)OC.[OH-]
InChIInChI=1S/C15H36NO3Si.H2O/c1-8-12-16(13-9-2,14-10-3)15(11-4)20(17-5,18-6)19-7;/h15H,8-14H2,1-7H3;1H2/q+1;/p-1
InChIKeyUICFOKVKNVQIOM-UHFFFAOYSA-M
MW323.55 g/mol
LogP3.05
Rot. Bonds12

About tripropyl(1-trimethoxysilylpropyl)azanium hydroxide

tripropyl(1-trimethoxysilylpropyl)azanium hydroxide (PubChem CID 87513848) has the molecular formula C15H37NO4Si and a molecular weight of 323.55 g/mol. Its IUPAC name is tripropyl(1-trimethoxysilylpropyl)azanium hydroxide.

Molecular Properties

Compound Nametripropyl(1-trimethoxysilylpropyl)azanium hydroxide
PubChem CID87513848
Molecular FormulaC15H37NO4Si
Molecular Weight323.55 g/mol
Exact Mass323.25
IUPAC Nametripropyl(1-trimethoxysilylpropyl)azanium hydroxide
SMILESCCC[N+](CCC)(CCC)C(CC)[Si](OC)(OC)OC.[OH-]
InChIInChI=1S/C15H36NO3Si.H2O/c1-8-12-16(13-9-2,14-10-3)15(11-4)20(17-5,18-6)19-7;/h15H,8-14H2,1-7H3;1H2/q+1;/p-1
InChIKeyUICFOKVKNVQIOM-UHFFFAOYSA-M
XLogP3.05
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.55
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

trimethyl(1-trimethoxysilylpropyl)azanium hydroxide
CID 87514002
dodecyl-dimethyl-(1-trimethoxysilylpropyl)azanium bromide
CID 175037692
trihexyl(1-triethoxysilylpropyl)azanium
CID 57211677
tributyl(1-trimethoxysilylethyl)azanium chloride
CID 23089800
1-butoxypropyl(trimethoxy)silane
CID 174729395
1-hydroxyethyl(tripropyl)azanium hydroxide
CID 88798296
methyl 2-trimethoxysilylbutanoate
CID 141147304
N-methyl-1-trimethoxysilylpropan-1-amine
CID 19607493
N,N-dimethyl-1-trimethoxysilylpropan-1-amine;silane
CID 173312185
5,5-diethylheptan-3-yl(tripropyl)azanium hydroxide
CID 141282397
carboxymethyl-pentan-3-yl-dipropylazanium
CID 24832995
hydroxy-dimethyl-(1-trimethoxysilylpropyl)silane
CID 173175510

Frequently Asked Questions

What is the IUPAC name of tripropyl(1-trimethoxysilylpropyl)azanium hydroxide?
The IUPAC name of tripropyl(1-trimethoxysilylpropyl)azanium hydroxide (CID 87513848) is tripropyl(1-trimethoxysilylpropyl)azanium hydroxide.
What is the SMILES notation for tripropyl(1-trimethoxysilylpropyl)azanium hydroxide?
The canonical SMILES for tripropyl(1-trimethoxysilylpropyl)azanium hydroxide is CCC[N+](CCC)(CCC)C(CC)[Si](OC)(OC)OC.[OH-].
What is the InChIKey of tripropyl(1-trimethoxysilylpropyl)azanium hydroxide?
The InChIKey is UICFOKVKNVQIOM-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H36NO3Si.H2O/c1-8-12-16(13-9-2,14-10-3)15(11-4)20(17-5,18-6)19-7;/h15H,8-14H2,1-7H3;1H2/q+1;/p-1.
What are the key properties of tripropyl(1-trimethoxysilylpropyl)azanium hydroxide?
tripropyl(1-trimethoxysilylpropyl)azanium hydroxide has a molecular weight of 323.55 g/mol, XLogP of 3.05, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tripropyl(1-trimethoxysilylpropyl)azanium hydroxide is sourced from PubChem (CID 87513848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).