N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine

C8H22N2O3Si — CID 22661604

IUPACN'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine
SMILESCO[Si](CC(C)NCCN)(OC)OC
InChIInChI=1S/C8H22N2O3Si/c1-8(10-6-5-9)7-14(11-2,12-3)13-4/h8,10H,5-7,9H2,1-4H3
InChIKeyXRAYTRHUIGYKJR-UHFFFAOYSA-N
MW222.36 g/mol
LogP-0.20
Rot. Bonds8

About N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine

N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine (PubChem CID 22661604) has the molecular formula C8H22N2O3Si and a molecular weight of 222.36 g/mol. Its IUPAC name is N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine
PubChem CID22661604
Molecular FormulaC8H22N2O3Si
Molecular Weight222.36 g/mol
Exact Mass222.14
IUPAC NameN'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine
SMILESCO[Si](CC(C)NCCN)(OC)OC
InChIInChI=1S/C8H22N2O3Si/c1-8(10-6-5-9)7-14(11-2,12-3)13-4/h8,10H,5-7,9H2,1-4H3
InChIKeyXRAYTRHUIGYKJR-UHFFFAOYSA-N
XLogP-0.20
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 ≤ 5-0.20
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

N'-(1-trimethoxysilylethyl)ethane-1,2-diamine
CID 21267592
2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine
CID 87271772
N'-butan-2-ylethane-1,2-diamine;ethane
CID 142992990
CID 172753617
CID 172753617
N'-(2-aminoethyl)ethane-1,2-diamine;3-trimethoxysilylpropan-1-amine
CID 158654505
N'-[2-(3-trimethoxysilylpropylamino)ethyl]ethane-1,2-diamine
CID 159586592
N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine
CID 67241279
N'-(8-trimethoxysilyloctyl)ethane-1,2-diamine
CID 132554515
N'-[1-(2-methoxyphenyl)ethyl]ethane-1,2-diamine
CID 60887758
N'-[1-[diethoxy(2-methylpropyl)silyl]oxyethyl]ethane-1,2-diamine
CID 154308383
N'-(1-iodoethyl)ethane-1,2-diamine
CID 89021038
N'-[3-[methoxy(dimethyl)silyl]-2-methylpropyl]ethane-1,2-diamine
CID 53421710

Frequently Asked Questions

What is the IUPAC name of N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine?
The IUPAC name of N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine (CID 22661604) is N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine?
The canonical SMILES for N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine is CO[Si](CC(C)NCCN)(OC)OC.
What is the InChIKey of N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine?
The InChIKey is XRAYTRHUIGYKJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H22N2O3Si/c1-8(10-6-5-9)7-14(11-2,12-3)13-4/h8,10H,5-7,9H2,1-4H3.
What are the key properties of N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine?
N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine has a molecular weight of 222.36 g/mol, XLogP of -0.20, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 22661604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).