2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine

C15H27NOSi — CID 167728474

IUPAC2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine
SMILESCNCCc1cccc(O[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C15H27NOSi/c1-15(2,3)18(5,6)17-14-9-7-8-13(12-14)10-11-16-4/h7-9,12,16H,10-11H2,1-6H3
InChIKeyVGUXVKPYPCLMMJ-UHFFFAOYSA-N
MW265.47 g/mol
LogP3.83
Rot. Bonds5

About 2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine

2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine (PubChem CID 167728474) has the molecular formula C15H27NOSi and a molecular weight of 265.47 g/mol. Its IUPAC name is 2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine.

Molecular Properties

Compound Name2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine
PubChem CID167728474
Molecular FormulaC15H27NOSi
Molecular Weight265.47 g/mol
Exact Mass265.19
IUPAC Name2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine
SMILESCNCCc1cccc(O[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C15H27NOSi/c1-15(2,3)18(5,6)17-14-9-7-8-13(12-14)10-11-16-4/h7-9,12,16H,10-11H2,1-6H3
InChIKeyVGUXVKPYPCLMMJ-UHFFFAOYSA-N
XLogP3.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.47
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[4-[tert-butyl(dimethyl)silyl]oxy-3-methoxyphenyl]-N-methylethanamine
CID 167731618
methyl 2-[[3-[tert-butyl(dimethyl)silyl]oxyphenyl]methylamino]acetate
CID 59524403
tert-butyl-(3-iodophenoxy)-dimethylsilane
CID 2757280
methyl 2-[[3-[tert-butyl(dimethyl)silyl]oxyphenyl]methylamino]-3-hydroxy-2-methylpropanoate
CID 59524397
methyl 2-[3-[2-(methylamino)ethyl]phenoxy]acetate
CID 59419918
tert-butyl-dimethyl-(4-phenylmethoxyphenoxy)silane
CID 532661
tert-butyl-[4-[(4-methoxyphenyl)methyl]phenoxy]-dimethylsilane
CID 23553287
N-methyl-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 23512860
1-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]propan-1-one
CID 15049953
1-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]ethanol
CID 66660384
[4-benzyl-2-(2-phenylethyl)quinazolin-6-yl]oxy-tert-butyl-dimethylsilane
CID 102154881
tert-butyl-[3-cyclopropyl-4-(2-phenylethyl)phenoxy]-dimethylsilane
CID 123543727

Frequently Asked Questions

What is the IUPAC name of 2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine?
The IUPAC name of 2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine (CID 167728474) is 2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine.
What is the SMILES notation for 2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine?
The canonical SMILES for 2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine is CNCCc1cccc(O[Si](C)(C)C(C)(C)C)c1.
What is the InChIKey of 2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine?
The InChIKey is VGUXVKPYPCLMMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NOSi/c1-15(2,3)18(5,6)17-14-9-7-8-13(12-14)10-11-16-4/h7-9,12,16H,10-11H2,1-6H3.
What are the key properties of 2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine?
2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine has a molecular weight of 265.47 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-methylethanamine is sourced from PubChem (CID 167728474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).