N-[butyl-(dimethylamino)-propylsilyl]ethanamine

C11H28N2Si — CID 87334291

IUPACN-[butyl-(dimethylamino)-propylsilyl]ethanamine
SMILESCCCC[Si](CCC)(NCC)N(C)C
InChIInChI=1S/C11H28N2Si/c1-6-9-11-14(10-7-2,12-8-3)13(4)5/h12H,6-11H2,1-5H3
InChIKeyAAKVKXVQJOOFIO-UHFFFAOYSA-N
MW216.44 g/mol
LogP2.81
Rot. Bonds8

About N-[butyl-(dimethylamino)-propylsilyl]ethanamine

N-[butyl-(dimethylamino)-propylsilyl]ethanamine (PubChem CID 87334291) has the molecular formula C11H28N2Si and a molecular weight of 216.44 g/mol. Its IUPAC name is N-[butyl-(dimethylamino)-propylsilyl]ethanamine.

Molecular Properties

Compound NameN-[butyl-(dimethylamino)-propylsilyl]ethanamine
PubChem CID87334291
Molecular FormulaC11H28N2Si
Molecular Weight216.44 g/mol
Exact Mass216.20
IUPAC NameN-[butyl-(dimethylamino)-propylsilyl]ethanamine
SMILESCCCC[Si](CCC)(NCC)N(C)C
InChIInChI=1S/C11H28N2Si/c1-6-9-11-14(10-7-2,12-8-3)13(4)5/h12H,6-11H2,1-5H3
InChIKeyAAKVKXVQJOOFIO-UHFFFAOYSA-N
XLogP2.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.44
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 N-[butyl-(dimethylamino)-propylsilyl]ethanamine?
The IUPAC name of N-[butyl-(dimethylamino)-propylsilyl]ethanamine (CID 87334291) is N-[butyl-(dimethylamino)-propylsilyl]ethanamine.
What is the SMILES notation for N-[butyl-(dimethylamino)-propylsilyl]ethanamine?
The canonical SMILES for N-[butyl-(dimethylamino)-propylsilyl]ethanamine is CCCC[Si](CCC)(NCC)N(C)C.
What is the InChIKey of N-[butyl-(dimethylamino)-propylsilyl]ethanamine?
The InChIKey is AAKVKXVQJOOFIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H28N2Si/c1-6-9-11-14(10-7-2,12-8-3)13(4)5/h12H,6-11H2,1-5H3.
What are the key properties of N-[butyl-(dimethylamino)-propylsilyl]ethanamine?
N-[butyl-(dimethylamino)-propylsilyl]ethanamine has a molecular weight of 216.44 g/mol, XLogP of 2.81, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[butyl-(dimethylamino)-propylsilyl]ethanamine is sourced from PubChem (CID 87334291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).