N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine

C15H35NO3Si — CID 20659214

IUPACN-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine
SMILESCCCCN(CCCC)CCC[Si](OC)(OC)OCC
InChIInChI=1S/C15H35NO3Si/c1-6-9-12-16(13-10-7-2)14-11-15-20(17-4,18-5)19-8-3/h6-15H2,1-5H3
InChIKeyYLSOMMSHFVJFOD-UHFFFAOYSA-N
MW305.54 g/mol
LogP3.55
Rot. Bonds14

About N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine

N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine (PubChem CID 20659214) has the molecular formula C15H35NO3Si and a molecular weight of 305.54 g/mol. Its IUPAC name is N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine.

Molecular Properties

Compound NameN-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine
PubChem CID20659214
Molecular FormulaC15H35NO3Si
Molecular Weight305.54 g/mol
Exact Mass305.24
IUPAC NameN-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine
SMILESCCCCN(CCCC)CCC[Si](OC)(OC)OCC
InChIInChI=1S/C15H35NO3Si/c1-6-9-12-16(13-10-7-2)14-11-15-20(17-4,18-5)19-8-3/h6-15H2,1-5H3
InChIKeyYLSOMMSHFVJFOD-UHFFFAOYSA-N
XLogP3.55
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.54
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine?
The IUPAC name of N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine (CID 20659214) is N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine.
What is the SMILES notation for N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine?
The canonical SMILES for N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine is CCCCN(CCCC)CCC[Si](OC)(OC)OCC.
What is the InChIKey of N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine?
The InChIKey is YLSOMMSHFVJFOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H35NO3Si/c1-6-9-12-16(13-10-7-2)14-11-15-20(17-4,18-5)19-8-3/h6-15H2,1-5H3.
What are the key properties of N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine?
N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine has a molecular weight of 305.54 g/mol, XLogP of 3.55, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-[3-[ethoxy(dimethoxy)silyl]propyl]butan-1-amine is sourced from PubChem (CID 20659214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).