N-[butyl(dipropoxy)silyl]butan-1-amine

C14H33NO2Si — CID 87635455

IUPACN-[butyl(dipropoxy)silyl]butan-1-amine
SMILESCCCCN[Si](CCCC)(OCCC)OCCC
InChIInChI=1S/C14H33NO2Si/c1-5-9-11-15-18(14-10-6-2,16-12-7-3)17-13-8-4/h15H,5-14H2,1-4H3
InChIKeyRGBYIACSRPDKIM-UHFFFAOYSA-N
MW275.51 g/mol
LogP3.97
Rot. Bonds13

About N-[butyl(dipropoxy)silyl]butan-1-amine

N-[butyl(dipropoxy)silyl]butan-1-amine (PubChem CID 87635455) has the molecular formula C14H33NO2Si and a molecular weight of 275.51 g/mol. Its IUPAC name is N-[butyl(dipropoxy)silyl]butan-1-amine.

Molecular Properties

Compound NameN-[butyl(dipropoxy)silyl]butan-1-amine
PubChem CID87635455
Molecular FormulaC14H33NO2Si
Molecular Weight275.51 g/mol
Exact Mass275.23
IUPAC NameN-[butyl(dipropoxy)silyl]butan-1-amine
SMILESCCCCN[Si](CCCC)(OCCC)OCCC
InChIInChI=1S/C14H33NO2Si/c1-5-9-11-15-18(14-10-6-2,16-12-7-3)17-13-8-4/h15H,5-14H2,1-4H3
InChIKeyRGBYIACSRPDKIM-UHFFFAOYSA-N
XLogP3.97
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.51
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[butyl(dipropoxy)silyl]butan-1-amine?
The IUPAC name of N-[butyl(dipropoxy)silyl]butan-1-amine (CID 87635455) is N-[butyl(dipropoxy)silyl]butan-1-amine.
What is the SMILES notation for N-[butyl(dipropoxy)silyl]butan-1-amine?
The canonical SMILES for N-[butyl(dipropoxy)silyl]butan-1-amine is CCCCN[Si](CCCC)(OCCC)OCCC.
What is the InChIKey of N-[butyl(dipropoxy)silyl]butan-1-amine?
The InChIKey is RGBYIACSRPDKIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H33NO2Si/c1-5-9-11-15-18(14-10-6-2,16-12-7-3)17-13-8-4/h15H,5-14H2,1-4H3.
What are the key properties of N-[butyl(dipropoxy)silyl]butan-1-amine?
N-[butyl(dipropoxy)silyl]butan-1-amine has a molecular weight of 275.51 g/mol, XLogP of 3.97, 13 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[butyl(dipropoxy)silyl]butan-1-amine is sourced from PubChem (CID 87635455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).