2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine

C20H43NO3Si4 — CID 524460

IUPAC2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine
SMILESC[Si](C)(C)NCC(O[Si](C)(C)C)c1ccc(O[Si](C)(C)C)c(O[Si](C)(C)C)c1
InChIInChI=1S/C20H43NO3Si4/c1-25(2,3)21-16-20(24-28(10,11)12)17-13-14-18(22-26(4,5)6)19(15-17)23-27(7,8)9/h13-15,20-21H,16H2,1-12H3
InChIKeyMLHNBOALOLAGFS-UHFFFAOYSA-N
MW457.91 g/mol
LogP6.43
Rot. Bonds10

About 2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine

2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine (PubChem CID 524460) has the molecular formula C20H43NO3Si4 and a molecular weight of 457.91 g/mol. Its IUPAC name is 2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine.

Molecular Properties

Compound Name2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine
PubChem CID524460
Molecular FormulaC20H43NO3Si4
Molecular Weight457.91 g/mol
Exact Mass457.23
IUPAC Name2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine
SMILESC[Si](C)(C)NCC(O[Si](C)(C)C)c1ccc(O[Si](C)(C)C)c(O[Si](C)(C)C)c1
InChIInChI=1S/C20H43NO3Si4/c1-25(2,3)21-16-20(24-28(10,11)12)17-13-14-18(22-26(4,5)6)19(15-17)23-27(7,8)9/h13-15,20-21H,16H2,1-12H3
InChIKeyMLHNBOALOLAGFS-UHFFFAOYSA-N
XLogP6.43
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500457.91
LogP ≤ 56.43
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

N-[5-[2-[1-(4-methoxyphenyl)propan-2-ylamino]-1-trimethylsilyloxyethyl]-2-trimethylsilyloxyphenyl]-N-trimethylsilylformamide
CID 633401
2-(3-methoxy-4-trimethylsilyloxyphenyl)-N-trimethylsilylethanamine
CID 530100
[4-acetyloxy-6-(1-trimethylsilyloxybutyl)naphthalen-1-yl] acetate
CID 14278001
2-(3,4-dimethoxyphenyl)-2-trimethylsilyloxyacetonitrile
CID 13439664
[1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane
CID 162501255
[1-(4-chlorophenyl)-4-trimethylsilylbutoxy]-trimethylsilane
CID 10373638
trimethyl-[4-[1,2,2-tris(4-trimethylsilyloxyphenyl)ethyl]phenoxy]silane
CID 139887552
4-(1,2-dimethoxyethyl)-1,2-dimethoxybenzene
CID 6424872
[2-methoxy-4-[2-(2-trimethylsilyloxyethoxy)ethyl]phenoxy]-trimethylsilane
CID 568566
(5-fluoro-2-trimethylsilyloxyphenyl)methanamine
CID 167725830
(1R)-2-amino-1-(3,4-dimethoxyphenyl)ethanol;hydrochloride
CID 163203583
N-[cycloheptyl-(3,4-dimethoxyphenyl)methyl]ethanamine
CID 62587576

Frequently Asked Questions

What is the IUPAC name of 2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine?
The IUPAC name of 2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine (CID 524460) is 2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine.
What is the SMILES notation for 2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine?
The canonical SMILES for 2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine is C[Si](C)(C)NCC(O[Si](C)(C)C)c1ccc(O[Si](C)(C)C)c(O[Si](C)(C)C)c1.
What is the InChIKey of 2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine?
The InChIKey is MLHNBOALOLAGFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H43NO3Si4/c1-25(2,3)21-16-20(24-28(10,11)12)17-13-14-18(22-26(4,5)6)19(15-17)23-27(7,8)9/h13-15,20-21H,16H2,1-12H3.
What are the key properties of 2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine?
2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine has a molecular weight of 457.91 g/mol, XLogP of 6.43, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,4-bis(trimethylsilyloxy)phenyl]-N-trimethylsilyl-2-trimethylsilyloxyethanamine is sourced from PubChem (CID 524460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).