N'-(1-trimethoxysilylethyl)ethane-1,2-diamine

C7H20N2O3Si — CID 21267592

IUPACN'-(1-trimethoxysilylethyl)ethane-1,2-diamine
SMILESCO[Si](OC)(OC)C(C)NCCN
InChIInChI=1S/C7H20N2O3Si/c1-7(9-6-5-8)13(10-2,11-3)12-4/h7,9H,5-6,8H2,1-4H3
InChIKeyYBAMSCJIINMXPI-UHFFFAOYSA-N
MW208.33 g/mol
LogP-0.66
Rot. Bonds7

About N'-(1-trimethoxysilylethyl)ethane-1,2-diamine

N'-(1-trimethoxysilylethyl)ethane-1,2-diamine (PubChem CID 21267592) has the molecular formula C7H20N2O3Si and a molecular weight of 208.33 g/mol. Its IUPAC name is N'-(1-trimethoxysilylethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(1-trimethoxysilylethyl)ethane-1,2-diamine
PubChem CID21267592
Molecular FormulaC7H20N2O3Si
Molecular Weight208.33 g/mol
Exact Mass208.12
IUPAC NameN'-(1-trimethoxysilylethyl)ethane-1,2-diamine
SMILESCO[Si](OC)(OC)C(C)NCCN
InChIInChI=1S/C7H20N2O3Si/c1-7(9-6-5-8)13(10-2,11-3)12-4/h7,9H,5-6,8H2,1-4H3
InChIKeyYBAMSCJIINMXPI-UHFFFAOYSA-N
XLogP-0.66
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.33
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N'-(1-trimethoxysilylethyl)ethane-1,2-diamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-(1-trimethoxysilylethyl)ethane-1,2-diamine?
The IUPAC name of N'-(1-trimethoxysilylethyl)ethane-1,2-diamine (CID 21267592) is N'-(1-trimethoxysilylethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(1-trimethoxysilylethyl)ethane-1,2-diamine?
The canonical SMILES for N'-(1-trimethoxysilylethyl)ethane-1,2-diamine is CO[Si](OC)(OC)C(C)NCCN.
What is the InChIKey of N'-(1-trimethoxysilylethyl)ethane-1,2-diamine?
The InChIKey is YBAMSCJIINMXPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H20N2O3Si/c1-7(9-6-5-8)13(10-2,11-3)12-4/h7,9H,5-6,8H2,1-4H3.
What are the key properties of N'-(1-trimethoxysilylethyl)ethane-1,2-diamine?
N'-(1-trimethoxysilylethyl)ethane-1,2-diamine has a molecular weight of 208.33 g/mol, XLogP of -0.66, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-trimethoxysilylethyl)ethane-1,2-diamine is sourced from PubChem (CID 21267592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).