N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine

C16H37NSi2 — CID 87571094

IUPACN-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine
SMILESC/C=C(\C)[Si](CC)(NCCCC)[Si](CC)(CC)CC
InChIInChI=1S/C16H37NSi2/c1-8-14-15-17-19(13-6,16(7)9-2)18(10-3,11-4)12-5/h9,17H,8,10-15H2,1-7H3/b16-9+
InChIKeyNYHDNTSGXVOAFD-CXUHLZMHSA-N
MW299.65 g/mol
LogP5.43
Rot. Bonds10

About N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine

N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine (PubChem CID 87571094) has the molecular formula C16H37NSi2 and a molecular weight of 299.65 g/mol. Its IUPAC name is N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine.

Molecular Properties

Compound NameN-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine
PubChem CID87571094
Molecular FormulaC16H37NSi2
Molecular Weight299.65 g/mol
Exact Mass299.25
IUPAC NameN-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine
SMILESC/C=C(\C)[Si](CC)(NCCCC)[Si](CC)(CC)CC
InChIInChI=1S/C16H37NSi2/c1-8-14-15-17-19(13-6,16(7)9-2)18(10-3,11-4)12-5/h9,17H,8,10-15H2,1-7H3/b16-9+
InChIKeyNYHDNTSGXVOAFD-CXUHLZMHSA-N
XLogP5.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.65
LogP ≤ 55.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]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-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine?
The IUPAC name of N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine (CID 87571094) is N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine.
What is the SMILES notation for N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine?
The canonical SMILES for N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine is C/C=C(\C)[Si](CC)(NCCCC)[Si](CC)(CC)CC.
What is the InChIKey of N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine?
The InChIKey is NYHDNTSGXVOAFD-CXUHLZMHSA-N. The full InChI is InChI=1S/C16H37NSi2/c1-8-14-15-17-19(13-6,16(7)9-2)18(10-3,11-4)12-5/h9,17H,8,10-15H2,1-7H3/b16-9+.
What are the key properties of N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine?
N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine has a molecular weight of 299.65 g/mol, XLogP of 5.43, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(E)-but-2-en-2-yl]-ethyl-triethylsilylsilyl]butan-1-amine is sourced from PubChem (CID 87571094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).