N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine

C19H50N4O6Si2 — CID 87775603

IUPACN'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine
SMILESCCO[Si](CCCNCCN)(OCC)OCC.CO[Si](CCCNCCN)(OC)OC
InChIInChI=1S/C11H28N2O3Si.C8H22N2O3Si/c1-4-14-17(15-5-2,16-6-3)11-7-9-13-10-8-12;1-11-14(12-2,13-3)8-4-6-10-7-5-9/h13H,4-12H2,1-3H3;10H,4-9H2,1-3H3
InChIKeyFIQAMKBXKOEHET-UHFFFAOYSA-N
MW486.80 g/mol
LogP0.78
Rot. Bonds21

About N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine

N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine (PubChem CID 87775603) has the molecular formula C19H50N4O6Si2 and a molecular weight of 486.80 g/mol. Its IUPAC name is N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine
PubChem CID87775603
Molecular FormulaC19H50N4O6Si2
Molecular Weight486.80 g/mol
Exact Mass486.33
IUPAC NameN'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine
SMILESCCO[Si](CCCNCCN)(OCC)OCC.CO[Si](CCCNCCN)(OC)OC
InChIInChI=1S/C11H28N2O3Si.C8H22N2O3Si/c1-4-14-17(15-5-2,16-6-3)11-7-9-13-10-8-12;1-11-14(12-2,13-3)8-4-6-10-7-5-9/h13H,4-12H2,1-3H3;10H,4-9H2,1-3H3
InChIKeyFIQAMKBXKOEHET-UHFFFAOYSA-N
XLogP0.78
TPSA131.48 Ų
H-Bond Donors4
H-Bond Acceptors10
Rotatable Bonds21
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.80
LogP ≤ 50.78
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1010

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'-(11-triethoxysilylundecyl)ethane-1,2-diamine
CID 87195550
N'-[2-(3-trimethoxysilylpropylamino)ethyl]ethane-1,2-diamine
CID 159586592
N-[3-[[diethoxy-[3-(3-triethoxysilylpropylamino)propyl]silyl]oxy-diethoxysilyl]propyl]-3-triethoxysilylpropan-1-amine
CID 171623585
N'-[3-[[[3-(2-aminoethylamino)propyl-diethoxysilyl]oxy-dimethylsilyl]oxy-diethoxysilyl]propyl]ethane-1,2-diamine
CID 169060435
N-ethyl-3-triethoxysilylpropan-1-amine;3-triethoxysilylpropan-1-amine
CID 88688172
N'-[3-(dimethoxymethylsilyl)propyl]ethane-1,2-diamine;N'-(3-triethoxysilylpropyl)ethane-1,2-diamine
CID 162079222
1-dimethoxysilylbutan-2-amine;N'-(3-triethoxysilylpropyl)ethane-1,2-diamine
CID 173380907
N'-(8-trimethoxysilyloctyl)ethane-1,2-diamine
CID 132554515
N'-(2-aminoethyl)ethane-1,2-diamine;3-trimethoxysilylpropan-1-amine
CID 158654505
propan-2-one;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine
CID 175097855
N'-(3-trimethoxysilylpropyl)hexane-1,6-diamine
CID 157123454
N-ethyl-3-triethoxysilylpropan-1-amine;silane
CID 161213931

Frequently Asked Questions

What is the IUPAC name of N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine?
The IUPAC name of N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine (CID 87775603) is N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine?
The canonical SMILES for N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine is CCO[Si](CCCNCCN)(OCC)OCC.CO[Si](CCCNCCN)(OC)OC.
What is the InChIKey of N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine?
The InChIKey is FIQAMKBXKOEHET-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H28N2O3Si.C8H22N2O3Si/c1-4-14-17(15-5-2,16-6-3)11-7-9-13-10-8-12;1-11-14(12-2,13-3)8-4-6-10-7-5-9/h13H,4-12H2,1-3H3;10H,4-9H2,1-3H3.
What are the key properties of N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine?
N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine has a molecular weight of 486.80 g/mol, XLogP of 0.78, 21 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine is sourced from PubChem (CID 87775603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).