N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline

C16H29NOSi — CID 123497942

IUPACN-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline
SMILESCCc1cccc(NCCO[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C16H29NOSi/c1-7-14-9-8-10-15(13-14)17-11-12-18-19(5,6)16(2,3)4/h8-10,13,17H,7,11-12H2,1-6H3
InChIKeyUCRGLZAGRKORRL-UHFFFAOYSA-N
MW279.50 g/mol
LogP4.68
Rot. Bonds6

About N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline

N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline (PubChem CID 123497942) has the molecular formula C16H29NOSi and a molecular weight of 279.50 g/mol. Its IUPAC name is N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline.

Molecular Properties

Compound NameN-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline
PubChem CID123497942
Molecular FormulaC16H29NOSi
Molecular Weight279.50 g/mol
Exact Mass279.20
IUPAC NameN-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline
SMILESCCc1cccc(NCCO[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C16H29NOSi/c1-7-14-9-8-10-15(13-14)17-11-12-18-19(5,6)16(2,3)4/h8-10,13,17H,7,11-12H2,1-6H3
InChIKeyUCRGLZAGRKORRL-UHFFFAOYSA-N
XLogP4.68
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.50
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-methylaniline
CID 144516245
N-(2-butoxyethyl)-3-ethylaniline
CID 61483073
CID 58064173
CID 58064173
4-(3-ethylanilino)-2-methylbutan-2-ol
CID 79360431
3-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-[(4-tert-butylphenyl)methyl]aniline
CID 11794388
N'-(3-ethylphenyl)methanediamine
CID 89312870
3-ethyl-N-(4-phenylbutyl)aniline
CID 114333153
tert-butyl-dimethyl-(2-phenylethoxy)silane
CID 11128311
2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane
CID 11515183
3-ethyl-N-(4-methylsulfanylbutyl)aniline
CID 103087215
ethyl 3-(3-ethylanilino)propanoate
CID 43365421
2-[tert-butyl(dimethyl)silyl]oxy-N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]ethanamine
CID 11427595

Frequently Asked Questions

What is the IUPAC name of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline?
The IUPAC name of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline (CID 123497942) is N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline.
What is the SMILES notation for N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline?
The canonical SMILES for N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline is CCc1cccc(NCCO[Si](C)(C)C(C)(C)C)c1.
What is the InChIKey of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline?
The InChIKey is UCRGLZAGRKORRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NOSi/c1-7-14-9-8-10-15(13-14)17-11-12-18-19(5,6)16(2,3)4/h8-10,13,17H,7,11-12H2,1-6H3.
What are the key properties of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline?
N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline has a molecular weight of 279.50 g/mol, XLogP of 4.68, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-ethylaniline is sourced from PubChem (CID 123497942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).