3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine

C9H24N2O2Si — CID 174975378

IUPAC3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine
SMILESCCO[Si](CC)(CCCN)OC(C)N
InChIInChI=1S/C9H24N2O2Si/c1-4-12-14(5-2,8-6-7-10)13-9(3)11/h9H,4-8,10-11H2,1-3H3
InChIKeyMTIKVMCHMIPYGS-UHFFFAOYSA-N
MW220.39 g/mol
LogP1.16
Rot. Bonds8

About 3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine

3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine (PubChem CID 174975378) has the molecular formula C9H24N2O2Si and a molecular weight of 220.39 g/mol. Its IUPAC name is 3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine.

Molecular Properties

Compound Name3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine
PubChem CID174975378
Molecular FormulaC9H24N2O2Si
Molecular Weight220.39 g/mol
Exact Mass220.16
IUPAC Name3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine
SMILESCCO[Si](CC)(CCCN)OC(C)N
InChIInChI=1S/C9H24N2O2Si/c1-4-12-14(5-2,8-6-7-10)13-9(3)11/h9H,4-8,10-11H2,1-3H3
InChIKeyMTIKVMCHMIPYGS-UHFFFAOYSA-N
XLogP1.16
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.39
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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Frequently Asked Questions

What is the IUPAC name of 3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine?
The IUPAC name of 3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine (CID 174975378) is 3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine.
What is the SMILES notation for 3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine?
The canonical SMILES for 3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine is CCO[Si](CC)(CCCN)OC(C)N.
What is the InChIKey of 3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine?
The InChIKey is MTIKVMCHMIPYGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H24N2O2Si/c1-4-12-14(5-2,8-6-7-10)13-9(3)11/h9H,4-8,10-11H2,1-3H3.
What are the key properties of 3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine?
3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine has a molecular weight of 220.39 g/mol, XLogP of 1.16, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-aminoethoxy-ethoxy-ethylsilyl)propan-1-amine is sourced from PubChem (CID 174975378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).