[tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate

C24H55NO4Si3 — CID 91743862

IUPAC[tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate
SMILESCC(C)(C)[Si](C)(C)OCCN(CCO[Si](C)(C)C(C)(C)C)CC(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C24H55NO4Si3/c1-22(2,3)30(10,11)27-18-16-25(17-19-28-31(12,13)23(4,5)6)20-21(26)29-32(14,15)24(7,8)9/h16-20H2,1-15H3
InChIKeyDPXHPUVAAJIVRG-UHFFFAOYSA-N
MW505.97 g/mol
LogP6.88
Rot. Bonds11

About [tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate

[tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate (PubChem CID 91743862) has the molecular formula C24H55NO4Si3 and a molecular weight of 505.97 g/mol. Its IUPAC name is [tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate.

Molecular Properties

Compound Name[tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate
PubChem CID91743862
Molecular FormulaC24H55NO4Si3
Molecular Weight505.97 g/mol
Exact Mass505.34
IUPAC Name[tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate
SMILESCC(C)(C)[Si](C)(C)OCCN(CCO[Si](C)(C)C(C)(C)C)CC(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C24H55NO4Si3/c1-22(2,3)30(10,11)27-18-16-25(17-19-28-31(12,13)23(4,5)6)20-21(26)29-32(14,15)24(7,8)9/h16-20H2,1-15H3
InChIKeyDPXHPUVAAJIVRG-UHFFFAOYSA-N
XLogP6.88
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500505.97
LogP ≤ 56.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid
CID 18751403
2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]ethyl 3-aminopropanoate
CID 57115648
3-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]propanoic acid
CID 164815617
methyl 2-[benzyl-[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate
CID 54470392
[tert-butyl(dimethyl)silyl] 5-[tert-butyl(dimethyl)silyl]oxypentanoate
CID 22907893
[tert-butyl(dimethyl)silyl] 2-chloroacetate
CID 4279826
N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-2-chloroacetamide
CID 15287415
bis[tert-butyl(dimethyl)silyl] hexanedioate
CID 528567
trimethylsilyl 2-[bis[2-[bis(2-oxo-2-trimethylsilyloxyethyl)amino]ethyl]amino]acetate
CID 91745582
[tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate
CID 91694129
3-O-[2-[tert-butyl(dimethyl)silyl]oxyethyl] 1-O-(2-methoxyethyl) propanedioate
CID 59364516
[tert-butyl(dimethyl)silyl] 2-[2-(2-methoxyethoxy)ethoxy]acetate
CID 91694127

Frequently Asked Questions

What is the IUPAC name of [tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate?
The IUPAC name of [tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate (CID 91743862) is [tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate.
What is the SMILES notation for [tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate?
The canonical SMILES for [tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate is CC(C)(C)[Si](C)(C)OCCN(CCO[Si](C)(C)C(C)(C)C)CC(=O)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of [tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate?
The InChIKey is DPXHPUVAAJIVRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H55NO4Si3/c1-22(2,3)30(10,11)27-18-16-25(17-19-28-31(12,13)23(4,5)6)20-21(26)29-32(14,15)24(7,8)9/h16-20H2,1-15H3.
What are the key properties of [tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate?
[tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate has a molecular weight of 505.97 g/mol, XLogP of 6.88, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate is sourced from PubChem (CID 91743862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).