N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine

C23H44N2Si — CID 164972132

IUPACN'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine
SMILES[SiH3]CCCNCCCCCCCCCCCCCNCc1ccccc1
InChIInChI=1S/C23H44N2Si/c26-21-15-20-24-18-13-8-6-4-2-1-3-5-7-9-14-19-25-22-23-16-11-10-12-17-23/h10-12,16-17,24-25H,1-9,13-15,18-22H2,26H3
InChIKeyXQAAQKLJKLIVNV-UHFFFAOYSA-N
MW376.71 g/mol
LogP4.83
Rot. Bonds19

About N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine

N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine (PubChem CID 164972132) has the molecular formula C23H44N2Si and a molecular weight of 376.71 g/mol. Its IUPAC name is N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine.

Molecular Properties

Compound NameN'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine
PubChem CID164972132
Molecular FormulaC23H44N2Si
Molecular Weight376.71 g/mol
Exact Mass376.33
IUPAC NameN'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine
SMILES[SiH3]CCCNCCCCCCCCCCCCCNCc1ccccc1
InChIInChI=1S/C23H44N2Si/c26-21-15-20-24-18-13-8-6-4-2-1-3-5-7-9-14-19-25-22-23-16-11-10-12-17-23/h10-12,16-17,24-25H,1-9,13-15,18-22H2,26H3
InChIKeyXQAAQKLJKLIVNV-UHFFFAOYSA-N
XLogP4.83
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds19
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.71
LogP ≤ 54.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-5-silylpentan-1-amine
CID 123625500
N,N'-bis[5-(benzylamino)pentyl]hexane-1,6-diamine;tetrahydrochloride
CID 72715173
N,N'-dibenzylhexane-1,6-diamine;dihydrobromide
CID 131880779
5-[4-(benzylamino)butylamino]pentan-1-ol
CID 22006369
N-(2-aminoethyl)-N'-[2-(benzylamino)ethyl]octane-1,8-diamine
CID 67649302
N-benzyl-13-[2-[3-(benzylamino)propyl]hydrazinyl]tridecan-1-amine
CID 57123635
N-benzyl-20-(2-silylhydrazinyl)icosan-1-amine
CID 123194590
CID 90351733
CID 90351733
N'-benzyl-N-(2-chloroethyl)hexane-1,6-diamine;dihydrochloride
CID 14086599
N'-benzylheptane-1,7-diamine
CID 61150072
N-benzyl-12-chlorododecan-1-amine
CID 175007443
N'-benzyldodecane-1,12-diamine
CID 10589617

Frequently Asked Questions

What is the IUPAC name of N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine?
The IUPAC name of N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine (CID 164972132) is N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine.
What is the SMILES notation for N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine?
The canonical SMILES for N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine is [SiH3]CCCNCCCCCCCCCCCCCNCc1ccccc1.
What is the InChIKey of N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine?
The InChIKey is XQAAQKLJKLIVNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H44N2Si/c26-21-15-20-24-18-13-8-6-4-2-1-3-5-7-9-14-19-25-22-23-16-11-10-12-17-23/h10-12,16-17,24-25H,1-9,13-15,18-22H2,26H3.
What are the key properties of N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine?
N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine has a molecular weight of 376.71 g/mol, XLogP of 4.83, 19 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-N-(3-silylpropyl)tridecane-1,13-diamine is sourced from PubChem (CID 164972132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).