N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine

C16H39N3Si — CID 141398149

IUPACN'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine
SMILESC[Si](C)(C)N(CCN)CCCCCCCCCCCN
InChIInChI=1S/C16H39N3Si/c1-20(2,3)19(16-14-18)15-12-10-8-6-4-5-7-9-11-13-17/h4-18H2,1-3H3
InChIKeyVLGOKYLOQUHOEJ-UHFFFAOYSA-N
MW301.60 g/mol
LogP3.55
Rot. Bonds14

About N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine

N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine (PubChem CID 141398149) has the molecular formula C16H39N3Si and a molecular weight of 301.60 g/mol. Its IUPAC name is N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine.

Molecular Properties

Compound NameN'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine
PubChem CID141398149
Molecular FormulaC16H39N3Si
Molecular Weight301.60 g/mol
Exact Mass301.29
IUPAC NameN'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine
SMILESC[Si](C)(C)N(CCN)CCCCCCCCCCCN
InChIInChI=1S/C16H39N3Si/c1-20(2,3)19(16-14-18)15-12-10-8-6-4-5-7-9-11-13-17/h4-18H2,1-3H3
InChIKeyVLGOKYLOQUHOEJ-UHFFFAOYSA-N
XLogP3.55
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.60
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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',N'-diaminopentane-1,5-diamine
CID 54100618
N'-(2-aminoethyl)-N'-methylpentane-1,5-diamine
CID 57004343
N',N'-dimethylpentane-1,5-diamine
CID 3465925
N',N'-dimethylicosane-1,20-diamine
CID 54351766
N',N'-dimethylheptane-1,7-diamine
CID 3822076
N',N'-bis(6-aminohexyl)hexane-1,6-diamine
CID 21260857
hexane-1,6-diamine;methanamine
CID 174275715
octatriacontane-1,38-diamine
CID 54235792
N',N'-diethylnonane-1,9-diamine
CID 22055140
icosane-1,20-diamine;nonadecane-1,19-diamine
CID 155315822
decane-1,10-diamine;nonane-1,9-diamine
CID 18179225
N'-[2-[2-(methylamino)ethyl-trimethylsilylamino]ethyl]ethane-1,2-diamine
CID 175146070

Frequently Asked Questions

What is the IUPAC name of N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine?
The IUPAC name of N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine (CID 141398149) is N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine.
What is the SMILES notation for N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine?
The canonical SMILES for N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine is C[Si](C)(C)N(CCN)CCCCCCCCCCCN.
What is the InChIKey of N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine?
The InChIKey is VLGOKYLOQUHOEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H39N3Si/c1-20(2,3)19(16-14-18)15-12-10-8-6-4-5-7-9-11-13-17/h4-18H2,1-3H3.
What are the key properties of N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine?
N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine has a molecular weight of 301.60 g/mol, XLogP of 3.55, 14 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-aminoethyl)-N'-trimethylsilylundecane-1,11-diamine is sourced from PubChem (CID 141398149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).