4-[butyl(dipropoxy)silyl]pentan-1-amine

C15H35NO2Si — CID 88812128

IUPAC4-[butyl(dipropoxy)silyl]pentan-1-amine
SMILESCCCC[Si](OCCC)(OCCC)C(C)CCCN
InChIInChI=1S/C15H35NO2Si/c1-5-8-14-19(17-12-6-2,18-13-7-3)15(4)10-9-11-16/h15H,5-14,16H2,1-4H3
InChIKeyQODJNCHPJVVEIA-UHFFFAOYSA-N
MW289.54 g/mol
LogP4.21
Rot. Bonds13

About 4-[butyl(dipropoxy)silyl]pentan-1-amine

4-[butyl(dipropoxy)silyl]pentan-1-amine (PubChem CID 88812128) has the molecular formula C15H35NO2Si and a molecular weight of 289.54 g/mol. Its IUPAC name is 4-[butyl(dipropoxy)silyl]pentan-1-amine.

Molecular Properties

Compound Name4-[butyl(dipropoxy)silyl]pentan-1-amine
PubChem CID88812128
Molecular FormulaC15H35NO2Si
Molecular Weight289.54 g/mol
Exact Mass289.24
IUPAC Name4-[butyl(dipropoxy)silyl]pentan-1-amine
SMILESCCCC[Si](OCCC)(OCCC)C(C)CCCN
InChIInChI=1S/C15H35NO2Si/c1-5-8-14-19(17-12-6-2,18-13-7-3)15(4)10-9-11-16/h15H,5-14,16H2,1-4H3
InChIKeyQODJNCHPJVVEIA-UHFFFAOYSA-N
XLogP4.21
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.54
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[butyl(dipropoxy)silyl]pentan-1-amine?
The IUPAC name of 4-[butyl(dipropoxy)silyl]pentan-1-amine (CID 88812128) is 4-[butyl(dipropoxy)silyl]pentan-1-amine.
What is the SMILES notation for 4-[butyl(dipropoxy)silyl]pentan-1-amine?
The canonical SMILES for 4-[butyl(dipropoxy)silyl]pentan-1-amine is CCCC[Si](OCCC)(OCCC)C(C)CCCN.
What is the InChIKey of 4-[butyl(dipropoxy)silyl]pentan-1-amine?
The InChIKey is QODJNCHPJVVEIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H35NO2Si/c1-5-8-14-19(17-12-6-2,18-13-7-3)15(4)10-9-11-16/h15H,5-14,16H2,1-4H3.
What are the key properties of 4-[butyl(dipropoxy)silyl]pentan-1-amine?
4-[butyl(dipropoxy)silyl]pentan-1-amine has a molecular weight of 289.54 g/mol, XLogP of 4.21, 13 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[butyl(dipropoxy)silyl]pentan-1-amine is sourced from PubChem (CID 88812128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).