3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine

C9H26N2O4Si2 — CID 123634431

IUPAC3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine
SMILESCO[SiH](CCCN)O[Si](CCCN)(OC)OC
InChIInChI=1S/C9H26N2O4Si2/c1-12-16(8-4-6-10)15-17(13-2,14-3)9-5-7-11/h16H,4-11H2,1-3H3
InChIKeyUNXIJIUBEHWAIX-UHFFFAOYSA-N
MW282.49 g/mol
LogP-0.20
Rot. Bonds11

About 3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine

3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine (PubChem CID 123634431) has the molecular formula C9H26N2O4Si2 and a molecular weight of 282.49 g/mol. Its IUPAC name is 3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine.

Molecular Properties

Compound Name3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine
PubChem CID123634431
Molecular FormulaC9H26N2O4Si2
Molecular Weight282.49 g/mol
Exact Mass282.14
IUPAC Name3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine
SMILESCO[SiH](CCCN)O[Si](CCCN)(OC)OC
InChIInChI=1S/C9H26N2O4Si2/c1-12-16(8-4-6-10)15-17(13-2,14-3)9-5-7-11/h16H,4-11H2,1-3H3
InChIKeyUNXIJIUBEHWAIX-UHFFFAOYSA-N
XLogP-0.20
TPSA88.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.49
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

bis(oxygen(2-));titanium(4+);3-trimethoxysilylpropan-1-amine
CID 161482517
cyclobutane;3-trimethoxysilylpropan-1-amine
CID 175187694
ethane;methanol;bis(3-trimethoxysilylpropan-1-amine)
CID 158708863
methanol;3-trimethoxysilylpropan-1-amine;hydrochloride
CID 174963553
3-[methoxy-di(propan-2-yloxy)silyl]propan-1-amine
CID 140917139
36-trimethoxysilylhexatriacontan-1-amine
CID 87680936
33-trimethoxysilyltritriacontan-1-amine
CID 87686996
3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine
CID 158758636
N'-(2-aminoethyl)ethane-1,2-diamine;3-trimethoxysilylpropan-1-amine
CID 158654505
3-(3-dimethoxysilylpropoxy)propyl-trimethoxysilane
CID 157097284
isothiocyanic acid;3-trimethoxysilylpropan-1-amine
CID 172722891
3-[diethoxy(methoxy)silyl]propan-1-amine;3-[ethoxy(dimethoxy)silyl]propan-1-amine;3-trimethoxysilylpropan-1-amine
CID 159243688

Frequently Asked Questions

What is the IUPAC name of 3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine?
The IUPAC name of 3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine (CID 123634431) is 3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine.
What is the SMILES notation for 3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine?
The canonical SMILES for 3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine is CO[SiH](CCCN)O[Si](CCCN)(OC)OC.
What is the InChIKey of 3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine?
The InChIKey is UNXIJIUBEHWAIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H26N2O4Si2/c1-12-16(8-4-6-10)15-17(13-2,14-3)9-5-7-11/h16H,4-11H2,1-3H3.
What are the key properties of 3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine?
3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine has a molecular weight of 282.49 g/mol, XLogP of -0.20, 11 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[3-aminopropyl(dimethoxy)silyl]oxy-methoxysilyl]propan-1-amine is sourced from PubChem (CID 123634431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).