N'-(2-trimethoxysilylethyl)methanediamine

C6H18N2O3Si — CID 18006728

IUPACN'-(2-trimethoxysilylethyl)methanediamine
SMILESCO[Si](CCNCN)(OC)OC
InChIInChI=1S/C6H18N2O3Si/c1-9-12(10-2,11-3)5-4-8-6-7/h8H,4-7H2,1-3H3
InChIKeyAAFXQWMJUGPMBZ-UHFFFAOYSA-N
MW194.31 g/mol
LogP-0.63
Rot. Bonds7

About N'-(2-trimethoxysilylethyl)methanediamine

N'-(2-trimethoxysilylethyl)methanediamine (PubChem CID 18006728) has the molecular formula C6H18N2O3Si and a molecular weight of 194.31 g/mol. Its IUPAC name is N'-(2-trimethoxysilylethyl)methanediamine.

Molecular Properties

Compound NameN'-(2-trimethoxysilylethyl)methanediamine
PubChem CID18006728
Molecular FormulaC6H18N2O3Si
Molecular Weight194.31 g/mol
Exact Mass194.11
IUPAC NameN'-(2-trimethoxysilylethyl)methanediamine
SMILESCO[Si](CCNCN)(OC)OC
InChIInChI=1S/C6H18N2O3Si/c1-9-12(10-2,11-3)5-4-8-6-7/h8H,4-7H2,1-3H3
InChIKeyAAFXQWMJUGPMBZ-UHFFFAOYSA-N
XLogP-0.63
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.31
LogP ≤ 5-0.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(2-trimethoxysilylethyl)methanediamine?
The IUPAC name of N'-(2-trimethoxysilylethyl)methanediamine (CID 18006728) is N'-(2-trimethoxysilylethyl)methanediamine.
What is the SMILES notation for N'-(2-trimethoxysilylethyl)methanediamine?
The canonical SMILES for N'-(2-trimethoxysilylethyl)methanediamine is CO[Si](CCNCN)(OC)OC.
What is the InChIKey of N'-(2-trimethoxysilylethyl)methanediamine?
The InChIKey is AAFXQWMJUGPMBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18N2O3Si/c1-9-12(10-2,11-3)5-4-8-6-7/h8H,4-7H2,1-3H3.
What are the key properties of N'-(2-trimethoxysilylethyl)methanediamine?
N'-(2-trimethoxysilylethyl)methanediamine has a molecular weight of 194.31 g/mol, XLogP of -0.63, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-trimethoxysilylethyl)methanediamine is sourced from PubChem (CID 18006728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).