4-[amino(diethoxy)silyl]oxybutan-1-amine

C8H22N2O3Si — CID 87267549

IUPAC4-[amino(diethoxy)silyl]oxybutan-1-amine
SMILESCCO[Si](N)(OCC)OCCCCN
InChIInChI=1S/C8H22N2O3Si/c1-3-11-14(10,12-4-2)13-8-6-5-7-9/h3-10H2,1-2H3
InChIKeyAEIVPRSZTXCYRG-UHFFFAOYSA-N
MW222.36 g/mol
LogP0.21
Rot. Bonds9

About 4-[amino(diethoxy)silyl]oxybutan-1-amine

4-[amino(diethoxy)silyl]oxybutan-1-amine (PubChem CID 87267549) has the molecular formula C8H22N2O3Si and a molecular weight of 222.36 g/mol. Its IUPAC name is 4-[amino(diethoxy)silyl]oxybutan-1-amine.

Molecular Properties

Compound Name4-[amino(diethoxy)silyl]oxybutan-1-amine
PubChem CID87267549
Molecular FormulaC8H22N2O3Si
Molecular Weight222.36 g/mol
Exact Mass222.14
IUPAC Name4-[amino(diethoxy)silyl]oxybutan-1-amine
SMILESCCO[Si](N)(OCC)OCCCCN
InChIInChI=1S/C8H22N2O3Si/c1-3-11-14(10,12-4-2)13-8-6-5-7-9/h3-10H2,1-2H3
InChIKeyAEIVPRSZTXCYRG-UHFFFAOYSA-N
XLogP0.21
TPSA79.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 50.21
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'}

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Related Compounds

4-aminobutyl triethyl silicate
CID 140519735
2-[amino(diethoxy)silyl]oxyethanamine
CID 174696376
6-trimethylsilyloxyhexan-1-amine
CID 529165
36-triethoxysilylhexatriacontan-1-amine
CID 87683625
6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine
CID 139707876
4-ethoxybutan-1-amine;hydrochloride
CID 87771260
6-tripentoxysilylhexan-1-amine
CID 152508476
12-triethoxysilyldodecan-1-amine;hydrochloride
CID 175579282
ethane-1,2-diamine;triethoxy(methyl)silane
CID 158658037
4-[diethoxy(propyl)silyl]butan-1-amine
CID 139765357
3-aminopropylsilyl triethyl silicate
CID 123662062
3-(3-triethoxysilylpropoxy)propan-1-amine
CID 54154158

Frequently Asked Questions

What is the IUPAC name of 4-[amino(diethoxy)silyl]oxybutan-1-amine?
The IUPAC name of 4-[amino(diethoxy)silyl]oxybutan-1-amine (CID 87267549) is 4-[amino(diethoxy)silyl]oxybutan-1-amine.
What is the SMILES notation for 4-[amino(diethoxy)silyl]oxybutan-1-amine?
The canonical SMILES for 4-[amino(diethoxy)silyl]oxybutan-1-amine is CCO[Si](N)(OCC)OCCCCN.
What is the InChIKey of 4-[amino(diethoxy)silyl]oxybutan-1-amine?
The InChIKey is AEIVPRSZTXCYRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H22N2O3Si/c1-3-11-14(10,12-4-2)13-8-6-5-7-9/h3-10H2,1-2H3.
What are the key properties of 4-[amino(diethoxy)silyl]oxybutan-1-amine?
4-[amino(diethoxy)silyl]oxybutan-1-amine has a molecular weight of 222.36 g/mol, XLogP of 0.21, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[amino(diethoxy)silyl]oxybutan-1-amine is sourced from PubChem (CID 87267549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).