6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide

C25H61N3O4Si4 — CID 22957542

IUPAC6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide
SMILESCCCN(CCC)C(=O)CCCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(CCCNCCN)O[Si](C)(C)C
InChIInChI=1S/C25H61N3O4Si4/c1-11-21-28(22-12-2)25(29)17-14-13-15-23-35(9,30-33(3,4)5)32-36(10,31-34(6,7)8)24-16-19-27-20-18-26/h27H,11-24,26H2,1-10H3
InChIKeyUKNXUNDHALMHAF-UHFFFAOYSA-N
MW580.12 g/mol
LogP6.00
Rot. Bonds22

About 6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide

6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide (PubChem CID 22957542) has the molecular formula C25H61N3O4Si4 and a molecular weight of 580.12 g/mol. Its IUPAC name is 6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide.

Molecular Properties

Compound Name6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide
PubChem CID22957542
Molecular FormulaC25H61N3O4Si4
Molecular Weight580.12 g/mol
Exact Mass579.37
IUPAC Name6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide
SMILESCCCN(CCC)C(=O)CCCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(CCCNCCN)O[Si](C)(C)C
InChIInChI=1S/C25H61N3O4Si4/c1-11-21-28(22-12-2)25(29)17-14-13-15-23-35(9,30-33(3,4)5)32-36(10,31-34(6,7)8)24-16-19-27-20-18-26/h27H,11-24,26H2,1-10H3
InChIKeyUKNXUNDHALMHAF-UHFFFAOYSA-N
XLogP6.00
TPSA86.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds22
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500580.12
LogP ≤ 56.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-[2-[2-(2-aminoethylamino)ethyl-docosanoylamino]ethyl]docosanamide
CID 21492333
CID 59904297
CID 59904297
4-amino-N,N-dipropylbutanamide
CID 12835718
N,N-didecyl-8-(octylamino)octanamide
CID 172581253
N-(3-aminopropyl)-N-propylnonanamide
CID 65448334
N-(2-aminoethyl)-N',N'-dipropylbutanediamide;hydrochloride
CID 119382280
N,N-dipropylnonadecanamide
CID 12960009
4-[[4-(dioctylamino)-4-oxobutyl]amino]-N,N-dioctylbutanamide
CID 164875605
[acetyloxy-[3-(2-aminoethylamino)propyl]-methylsilyl] acetate
CID 87568873
methyl 2-[6-aminohexanoyl(propyl)amino]acetate
CID 54871850
N-[2-[2-aminoethyl(dodecanoyl)amino]ethyl]dodecanamide
CID 13255836
N-[2-[2-aminoethyl(decanoyl)amino]ethyl]hexadecanamide
CID 102064097

Frequently Asked Questions

What is the IUPAC name of 6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide?
The IUPAC name of 6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide (CID 22957542) is 6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide.
What is the SMILES notation for 6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide?
The canonical SMILES for 6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide is CCCN(CCC)C(=O)CCCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(CCCNCCN)O[Si](C)(C)C.
What is the InChIKey of 6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide?
The InChIKey is UKNXUNDHALMHAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H61N3O4Si4/c1-11-21-28(22-12-2)25(29)17-14-13-15-23-35(9,30-33(3,4)5)32-36(10,31-34(6,7)8)24-16-19-27-20-18-26/h27H,11-24,26H2,1-10H3.
What are the key properties of 6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide?
6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide has a molecular weight of 580.12 g/mol, XLogP of 6.00, 22 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[3-(2-aminoethylamino)propyl-methyl-trimethylsilyloxysilyl]oxy-methyl-trimethylsilyloxysilyl]-N,N-dipropylhexanamide is sourced from PubChem (CID 22957542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).