N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine

C14H36N4Si — CID 10334332

IUPACN'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine
SMILESC[Si](C)(CCCNCCCN)CCCNCCCN
InChIInChI=1S/C14H36N4Si/c1-19(2,13-5-11-17-9-3-7-15)14-6-12-18-10-4-8-16/h17-18H,3-16H2,1-2H3
InChIKeyBWUMOPIXXXPQET-UHFFFAOYSA-N
MW288.56 g/mol
LogP1.35
Rot. Bonds14

About N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine

N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine (PubChem CID 10334332) has the molecular formula C14H36N4Si and a molecular weight of 288.56 g/mol. Its IUPAC name is N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine.

Molecular Properties

Compound NameN'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine
PubChem CID10334332
Molecular FormulaC14H36N4Si
Molecular Weight288.56 g/mol
Exact Mass288.27
IUPAC NameN'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine
SMILESC[Si](C)(CCCNCCCN)CCCNCCCN
InChIInChI=1S/C14H36N4Si/c1-19(2,13-5-11-17-9-3-7-15)14-6-12-18-10-4-8-16/h17-18H,3-16H2,1-2H3
InChIKeyBWUMOPIXXXPQET-UHFFFAOYSA-N
XLogP1.35
TPSA76.10 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.56
LogP ≤ 51.35
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine?
The IUPAC name of N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine (CID 10334332) is N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine.
What is the SMILES notation for N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine?
The canonical SMILES for N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine is C[Si](C)(CCCNCCCN)CCCNCCCN.
What is the InChIKey of N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine?
The InChIKey is BWUMOPIXXXPQET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H36N4Si/c1-19(2,13-5-11-17-9-3-7-15)14-6-12-18-10-4-8-16/h17-18H,3-16H2,1-2H3.
What are the key properties of N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine?
N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine has a molecular weight of 288.56 g/mol, XLogP of 1.35, 14 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[3-[3-(3-aminopropylamino)propyl-dimethylsilyl]propyl]propane-1,3-diamine is sourced from PubChem (CID 10334332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).