2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine

C11H28N2O3Si — CID 174459396

IUPAC2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine
SMILESCCO[Si](CC(C)N)(OCC)OC(C)(N)CC
InChIInChI=1S/C11H28N2O3Si/c1-6-11(5,13)16-17(14-7-2,15-8-3)9-10(4)12/h10H,6-9,12-13H2,1-5H3
InChIKeyFSOUFPUQXNVCKY-UHFFFAOYSA-N
MW264.44 g/mol
LogP1.45
Rot. Bonds9

About 2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine

2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine (PubChem CID 174459396) has the molecular formula C11H28N2O3Si and a molecular weight of 264.44 g/mol. Its IUPAC name is 2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine.

Molecular Properties

Compound Name2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine
PubChem CID174459396
Molecular FormulaC11H28N2O3Si
Molecular Weight264.44 g/mol
Exact Mass264.19
IUPAC Name2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine
SMILESCCO[Si](CC(C)N)(OCC)OC(C)(N)CC
InChIInChI=1S/C11H28N2O3Si/c1-6-11(5,13)16-17(14-7-2,15-8-3)9-10(4)12/h10H,6-9,12-13H2,1-5H3
InChIKeyFSOUFPUQXNVCKY-UHFFFAOYSA-N
XLogP1.45
TPSA79.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-triethoxysilylpropan-2-amine
CID 10236113
N-[2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-yl]prop-2-enamide
CID 159339342
1-[ethoxy(dimethyl)silyl]propan-2-amine
CID 57130729
3-methyl-2-triethoxysilylbutan-2-amine
CID 174653209
triethoxy-(3-ethyl-2-methylpentyl)silane
CID 18696416
(3,4-dichloro-2,5-dimethylhexyl)-triethoxysilane
CID 91420779
triethoxy(2,2,4-trimethylpentyl)silane
CID 21480871
3-(triethoxysilylmethyl)heptan-2-amine
CID 23048093
1-[butan-2-yloxy(dipropoxy)silyl]propan-2-amine
CID 174377064
N-[3-[2-aminopropyl(diethoxy)silyl]oxybutyl]prop-2-enamide
CID 158029719
2-methoxybutan-2-amine
CID 21116415
2-(1-methoxyethoxy)butan-2-amine
CID 155164738

Frequently Asked Questions

What is the IUPAC name of 2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine?
The IUPAC name of 2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine (CID 174459396) is 2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine.
What is the SMILES notation for 2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine?
The canonical SMILES for 2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine is CCO[Si](CC(C)N)(OCC)OC(C)(N)CC.
What is the InChIKey of 2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine?
The InChIKey is FSOUFPUQXNVCKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H28N2O3Si/c1-6-11(5,13)16-17(14-7-2,15-8-3)9-10(4)12/h10H,6-9,12-13H2,1-5H3.
What are the key properties of 2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine?
2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine has a molecular weight of 264.44 g/mol, XLogP of 1.45, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine is sourced from PubChem (CID 174459396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).