2-N-(2-triethoxysilylethyl)propane-1,2-diamine

C11H28N2O3Si — CID 59561197

IUPAC2-N-(2-triethoxysilylethyl)propane-1,2-diamine
SMILESCCO[Si](CCNC(C)CN)(OCC)OCC
InChIInChI=1S/C11H28N2O3Si/c1-5-14-17(15-6-2,16-7-3)9-8-13-11(4)10-12/h11,13H,5-10,12H2,1-4H3
InChIKeyPSDWTMLBYJRUFW-UHFFFAOYSA-N
MW264.44 g/mol
LogP0.97
Rot. Bonds11

About 2-N-(2-triethoxysilylethyl)propane-1,2-diamine

2-N-(2-triethoxysilylethyl)propane-1,2-diamine (PubChem CID 59561197) has the molecular formula C11H28N2O3Si and a molecular weight of 264.44 g/mol. Its IUPAC name is 2-N-(2-triethoxysilylethyl)propane-1,2-diamine.

Molecular Properties

Compound Name2-N-(2-triethoxysilylethyl)propane-1,2-diamine
PubChem CID59561197
Molecular FormulaC11H28N2O3Si
Molecular Weight264.44 g/mol
Exact Mass264.19
IUPAC Name2-N-(2-triethoxysilylethyl)propane-1,2-diamine
SMILESCCO[Si](CCNC(C)CN)(OCC)OCC
InChIInChI=1S/C11H28N2O3Si/c1-5-14-17(15-6-2,16-7-3)9-8-13-11(4)10-12/h11,13H,5-10,12H2,1-4H3
InChIKeyPSDWTMLBYJRUFW-UHFFFAOYSA-N
XLogP0.97
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2-triethoxysilylethoxy)propan-1-amine
CID 59561219
N'-[1-[diethoxy(2-methylpropyl)silyl]oxyethyl]ethane-1,2-diamine
CID 154308383
3-[1-aminoethoxy(diethoxy)silyl]-N-ethylpropan-1-amine
CID 87523892
3-[[(2S)-3-[3-aminopropyl(diethoxy)silyl]oxybutan-2-yl]oxy-diethoxysilyl]propan-1-amine
CID 58773749
triethoxy(10-triethoxysilyldecyl)silane
CID 14439044
ethoxysilane;N'-(1-triethoxysilylpropan-2-yl)methanediamine
CID 159811606
2-N-[2-(methylamino)ethyl]propane-1,2-diamine
CID 91508922
N'-(11-triethoxysilylundecyl)ethane-1,2-diamine
CID 87195550
N-ethyl-3-triethoxysilylpropan-1-amine;3-triethoxysilylpropan-1-amine
CID 88688172
N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine
CID 87775603
36-triethoxysilylhexatriacontan-1-amine
CID 87683625
N-[3-[[diethoxy-[3-(3-triethoxysilylpropylamino)propyl]silyl]oxy-diethoxysilyl]propyl]-3-triethoxysilylpropan-1-amine
CID 171623585

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-triethoxysilylethyl)propane-1,2-diamine?
The IUPAC name of 2-N-(2-triethoxysilylethyl)propane-1,2-diamine (CID 59561197) is 2-N-(2-triethoxysilylethyl)propane-1,2-diamine.
What is the SMILES notation for 2-N-(2-triethoxysilylethyl)propane-1,2-diamine?
The canonical SMILES for 2-N-(2-triethoxysilylethyl)propane-1,2-diamine is CCO[Si](CCNC(C)CN)(OCC)OCC.
What is the InChIKey of 2-N-(2-triethoxysilylethyl)propane-1,2-diamine?
The InChIKey is PSDWTMLBYJRUFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H28N2O3Si/c1-5-14-17(15-6-2,16-7-3)9-8-13-11(4)10-12/h11,13H,5-10,12H2,1-4H3.
What are the key properties of 2-N-(2-triethoxysilylethyl)propane-1,2-diamine?
2-N-(2-triethoxysilylethyl)propane-1,2-diamine has a molecular weight of 264.44 g/mol, XLogP of 0.97, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-triethoxysilylethyl)propane-1,2-diamine is sourced from PubChem (CID 59561197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).