2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine

C13H32N2O4Si — CID 87438219

IUPAC2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine
SMILESCCO[Si](CCCN)(OCC)OC(C)(C)C.NCC=O
InChIInChI=1S/C11H27NO3Si.C2H5NO/c1-6-13-16(14-7-2,10-8-9-12)15-11(3,4)5;3-1-2-4/h6-10,12H2,1-5H3;2H,1,3H2
InChIKeyZRYUJEKJUPOOTB-UHFFFAOYSA-N
MW308.50 g/mol
LogP1.31
Rot. Bonds9

About 2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine

2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine (PubChem CID 87438219) has the molecular formula C13H32N2O4Si and a molecular weight of 308.50 g/mol. Its IUPAC name is 2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine.

Molecular Properties

Compound Name2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine
PubChem CID87438219
Molecular FormulaC13H32N2O4Si
Molecular Weight308.50 g/mol
Exact Mass308.21
IUPAC Name2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine
SMILESCCO[Si](CCCN)(OCC)OC(C)(C)C.NCC=O
InChIInChI=1S/C11H27NO3Si.C2H5NO/c1-6-13-16(14-7-2,10-8-9-12)15-11(3,4)5;3-1-2-4/h6-10,12H2,1-5H3;2H,1,3H2
InChIKeyZRYUJEKJUPOOTB-UHFFFAOYSA-N
XLogP1.31
TPSA96.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.50
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

3-[[3-aminopropyl-[3-aminopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propan-1-amine
CID 143956342
sulfuric acid;3-triethoxysilylpropan-1-amine
CID 172732865
3-[diethoxy(methoxy)silyl]propan-1-amine;3-[ethoxy(dimethoxy)silyl]propan-1-amine;3-trimethoxysilylpropan-1-amine
CID 159243688
36-triethoxysilylhexatriacontan-1-amine
CID 87683625
[3-aminopropyl(diethoxy)silyl] triethyl silicate
CID 22065708
ethyl carbamate;3-triethoxysilylpropan-1-amine
CID 90205560
N-ethyl-3-triethoxysilylpropan-1-amine;3-triethoxysilylpropan-1-amine
CID 88688172
3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine
CID 139759530
12-triethoxysilyldodecan-1-amine;hydrochloride
CID 175579282
3-[[(2S)-3-[3-aminopropyl(diethoxy)silyl]oxybutan-2-yl]oxy-diethoxysilyl]propan-1-amine
CID 58773749
3-[[3-aminopropyl(diethoxy)silyl]oxy-diethoxysilyl]propylazanium
CID 164754127
3-(3-aminopropyl-ethoxy-methylsilyl)propan-1-amine
CID 87400628

Frequently Asked Questions

What is the IUPAC name of 2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine?
The IUPAC name of 2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine (CID 87438219) is 2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine.
What is the SMILES notation for 2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine?
The canonical SMILES for 2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine is CCO[Si](CCCN)(OCC)OC(C)(C)C.NCC=O.
What is the InChIKey of 2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine?
The InChIKey is ZRYUJEKJUPOOTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27NO3Si.C2H5NO/c1-6-13-16(14-7-2,10-8-9-12)15-11(3,4)5;3-1-2-4/h6-10,12H2,1-5H3;2H,1,3H2.
What are the key properties of 2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine?
2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine has a molecular weight of 308.50 g/mol, XLogP of 1.31, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine is sourced from PubChem (CID 87438219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).