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

C18H41NO4Si2 — CID 18751403

IUPAC2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid
SMILESCC(C)(C)[Si](C)(C)OCCN(CCO[Si](C)(C)C(C)(C)C)CC(=O)O
InChIInChI=1S/C18H41NO4Si2/c1-17(2,3)24(7,8)22-13-11-19(15-16(20)21)12-14-23-25(9,10)18(4,5)6/h11-15H2,1-10H3,(H,20,21)
InChIKeyMRRHBZXKJGGCLT-UHFFFAOYSA-N
MW391.70 g/mol
LogP4.42
Rot. Bonds10

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

2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid (PubChem CID 18751403) has the molecular formula C18H41NO4Si2 and a molecular weight of 391.70 g/mol. Its IUPAC name is 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid.

Molecular Properties

Compound Name2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid
PubChem CID18751403
Molecular FormulaC18H41NO4Si2
Molecular Weight391.70 g/mol
Exact Mass391.26
IUPAC Name2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid
SMILESCC(C)(C)[Si](C)(C)OCCN(CCO[Si](C)(C)C(C)(C)C)CC(=O)O
InChIInChI=1S/C18H41NO4Si2/c1-17(2,3)24(7,8)22-13-11-19(15-16(20)21)12-14-23-25(9,10)18(4,5)6/h11-15H2,1-10H3,(H,20,21)
InChIKeyMRRHBZXKJGGCLT-UHFFFAOYSA-N
XLogP4.42
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.70
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]propanoic acid
CID 164815617
[tert-butyl(dimethyl)silyl] 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate
CID 91743862
2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]ethyl 3-aminopropanoate
CID 57115648
2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]acetic acid
CID 170898180
methyl 2-[benzyl-[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetate
CID 54470392
N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-2-chloroacetamide
CID 15287415
3-[tert-butyl(dimethyl)silyl]oxypropyl-methylcarbamic acid
CID 87451074
2-[benzyl-[2-[tert-butyl(diphenyl)silyl]oxyethyl]amino]acetic acid
CID 67674409
2-[2-(dimethylamino)ethyl-[2-[(2-methylpropan-2-yl)oxy]ethyl]amino]acetic acid
CID 107425641
10-[2-[tert-butyl(dimethyl)silyl]oxyethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]decanoic acid
CID 10718218
15-[tert-butyl(dimethyl)silyl]oxy-9-oxopentadecanoic acid
CID 168962220
6-[tert-butyl(dimethyl)silyl]oxy-2-fluorohexanoic acid
CID 19776884

Frequently Asked Questions

What is the IUPAC name of 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid?
The IUPAC name of 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid (CID 18751403) is 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid.
What is the SMILES notation for 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid?
The canonical SMILES for 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid is CC(C)(C)[Si](C)(C)OCCN(CCO[Si](C)(C)C(C)(C)C)CC(=O)O.
What is the InChIKey of 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid?
The InChIKey is MRRHBZXKJGGCLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H41NO4Si2/c1-17(2,3)24(7,8)22-13-11-19(15-16(20)21)12-14-23-25(9,10)18(4,5)6/h11-15H2,1-10H3,(H,20,21).
What are the key properties of 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid?
2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid has a molecular weight of 391.70 g/mol, XLogP of 4.42, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]amino]acetic acid is sourced from PubChem (CID 18751403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).