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

C8H22N2O3Si — CID 19086198

IUPACN'-(1-trimethoxysilylpropyl)ethane-1,2-diamine
SMILESCCC(NCCN)[Si](OC)(OC)OC
InChIInChI=1S/C8H22N2O3Si/c1-5-8(10-7-6-9)14(11-2,12-3)13-4/h8,10H,5-7,9H2,1-4H3
InChIKeyGVVNVWMBOHQMEV-UHFFFAOYSA-N
MW222.36 g/mol
LogP-0.27
Rot. Bonds8

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

N'-(1-trimethoxysilylpropyl)ethane-1,2-diamine (PubChem CID 19086198) has the molecular formula C8H22N2O3Si and a molecular weight of 222.36 g/mol. Its IUPAC name is N'-(1-trimethoxysilylpropyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(1-trimethoxysilylpropyl)ethane-1,2-diamine
PubChem CID19086198
Molecular FormulaC8H22N2O3Si
Molecular Weight222.36 g/mol
Exact Mass222.14
IUPAC NameN'-(1-trimethoxysilylpropyl)ethane-1,2-diamine
SMILESCCC(NCCN)[Si](OC)(OC)OC
InChIInChI=1S/C8H22N2O3Si/c1-5-8(10-7-6-9)14(11-2,12-3)13-4/h8,10H,5-7,9H2,1-4H3
InChIKeyGVVNVWMBOHQMEV-UHFFFAOYSA-N
XLogP-0.27
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 5-0.27
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

(Trimethoxysilylpropyl)ethylenediamine
CID 15659
Bis(trimethoxysilylpropyl)amine
CID 157882
3-((Trimethoxysilyl)propyl)diethylenetriamine
CID 118771
N-(2-Aminoethyl)-3-aminopropylmethyldimethoxysilane
CID 76482
1-Butanamine, N-(3-(trimethoxysilyl)propyl)-
CID 160192
1-Propanamine, N-methyl-3-(trimethoxysilyl)-
CID 76480
1,2-Ethanediamine, N1-(3-(triethoxysilyl)propyl)-
CID 78772
N-(3-(dimethoxymethylsilyl)-2-methylpropyl)ethylenediamine
CID 90922
N,N'-Bis(3-(trimethoxysilyl)propyl)ethane-1,2-diamine
CID 111651
1-Propanamine, N-ethyl-2-methyl-3-(trimethoxysilyl)-
CID 11172079
N-(6-Aminohexyl)aminopropyltrimethoxysilane
CID 9925638
N-(3-(Methoxydimethylsilyl)propyl)ethylenediamine
CID 76484

Frequently Asked Questions

What is the IUPAC name of N'-(1-trimethoxysilylpropyl)ethane-1,2-diamine?
The IUPAC name of N'-(1-trimethoxysilylpropyl)ethane-1,2-diamine (CID 19086198) is N'-(1-trimethoxysilylpropyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(1-trimethoxysilylpropyl)ethane-1,2-diamine?
The canonical SMILES for N'-(1-trimethoxysilylpropyl)ethane-1,2-diamine is CCC(NCCN)[Si](OC)(OC)OC.
What is the InChIKey of N'-(1-trimethoxysilylpropyl)ethane-1,2-diamine?
The InChIKey is GVVNVWMBOHQMEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H22N2O3Si/c1-5-8(10-7-6-9)14(11-2,12-3)13-4/h8,10H,5-7,9H2,1-4H3.
What are the key properties of N'-(1-trimethoxysilylpropyl)ethane-1,2-diamine?
N'-(1-trimethoxysilylpropyl)ethane-1,2-diamine has a molecular weight of 222.36 g/mol, XLogP of -0.27, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-trimethoxysilylpropyl)ethane-1,2-diamine is sourced from PubChem (CID 19086198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).