4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline

C15H27NO2Si — CID 69452895

IUPAC4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline
SMILESCc1cc(OCCO[Si](C)(C)C(C)(C)C)ccc1N
InChIInChI=1S/C15H27NO2Si/c1-12-11-13(7-8-14(12)16)17-9-10-18-19(5,6)15(2,3)4/h7-8,11H,9-10,16H2,1-6H3
InChIKeyWMNMXFLMOCGTME-UHFFFAOYSA-N
MW281.47 g/mol
LogP3.98
Rot. Bonds5

About 4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline

4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline (PubChem CID 69452895) has the molecular formula C15H27NO2Si and a molecular weight of 281.47 g/mol. Its IUPAC name is 4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline.

Molecular Properties

Compound Name4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline
PubChem CID69452895
Molecular FormulaC15H27NO2Si
Molecular Weight281.47 g/mol
Exact Mass281.18
IUPAC Name4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline
SMILESCc1cc(OCCO[Si](C)(C)C(C)(C)C)ccc1N
InChIInChI=1S/C15H27NO2Si/c1-12-11-13(7-8-14(12)16)17-9-10-18-19(5,6)15(2,3)4/h7-8,11H,9-10,16H2,1-6H3
InChIKeyWMNMXFLMOCGTME-UHFFFAOYSA-N
XLogP3.98
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.47
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-[2-(4-propoxyphenoxy)ethoxy]silane
CID 22032995
tert-butyl-dimethyl-[2-(4-methyl-3-nitrophenoxy)ethoxy]silane
CID 69453503
4-(2-aminoethoxy)-2-methylaniline
CID 15870804
4-[2-(4-chloro-3-methylphenoxy)ethoxy]-2-methylaniline
CID 39399817
4-(2-aminoethoxy)-2-methylaniline;dihydrochloride
CID 164607051
tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane
CID 141377156
4-[2-(3,4-difluorophenoxy)ethoxy]-2-methylaniline
CID 39379204
tert-butyl-dimethyl-[2-[4-(trifluoromethyl)phenoxy]ethoxy]silane
CID 70670992
2-[2-(4-amino-3-methylphenoxy)ethoxy]ethanol
CID 61069192
2-methyl-4-[2-(2-methylphenoxy)ethoxy]aniline
CID 39359285
4-[2-[4-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]phenyl]ethynyl]aniline
CID 16659289
2-methyl-4-nonoxyaniline
CID 43128997

Frequently Asked Questions

What is the IUPAC name of 4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline?
The IUPAC name of 4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline (CID 69452895) is 4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline.
What is the SMILES notation for 4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline?
The canonical SMILES for 4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline is Cc1cc(OCCO[Si](C)(C)C(C)(C)C)ccc1N.
What is the InChIKey of 4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline?
The InChIKey is WMNMXFLMOCGTME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2Si/c1-12-11-13(7-8-14(12)16)17-9-10-18-19(5,6)15(2,3)4/h7-8,11H,9-10,16H2,1-6H3.
What are the key properties of 4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline?
4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline has a molecular weight of 281.47 g/mol, XLogP of 3.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline is sourced from PubChem (CID 69452895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).