2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline

C15H24N2OSi — CID 69338150

IUPAC2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline
SMILESCN(C)CCOc1ccc(C#C[Si](C)(C)C)cc1N
InChIInChI=1S/C15H24N2OSi/c1-17(2)9-10-18-15-7-6-13(12-14(15)16)8-11-19(3,4)5/h6-7,12H,9-10,16H2,1-5H3
InChIKeyXPPWQWQPVZQKAW-UHFFFAOYSA-N
MW276.46 g/mol
LogP2.44
Rot. Bonds4

About 2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline

2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline (PubChem CID 69338150) has the molecular formula C15H24N2OSi and a molecular weight of 276.46 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline
PubChem CID69338150
Molecular FormulaC15H24N2OSi
Molecular Weight276.46 g/mol
Exact Mass276.17
IUPAC Name2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline
SMILESCN(C)CCOc1ccc(C#C[Si](C)(C)C)cc1N
InChIInChI=1S/C15H24N2OSi/c1-17(2)9-10-18-15-7-6-13(12-14(15)16)8-11-19(3,4)5/h6-7,12H,9-10,16H2,1-5H3
InChIKeyXPPWQWQPVZQKAW-UHFFFAOYSA-N
XLogP2.44
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.46
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-amino-4-[2-(dimethylamino)ethoxy]benzonitrile
CID 61103813
2-[2-(dimethylamino)ethoxy]-5-iodoaniline
CID 66081959
3-amino-4-[2-(dimethylamino)ethoxy]-N-methylbenzamide
CID 79021333
2-(3,4-dimethoxyphenyl)ethynyl-trimethylsilane
CID 11160666
1-[3-amino-4-[2-(dimethylamino)ethoxy]phenyl]-2-methylpropan-1-one
CID 82064323
ethyl 4-[2-[ethyl(methyl)amino]-4-(2-trimethylsilylethynyl)phenoxy]butanoate
CID 170528615
4-[4-[2-(dimethylamino)ethoxy]-3-methylphenyl]but-3-yn-1-ol
CID 63214502
3-[3-amino-4-[2-(dimethylamino)ethoxy]phenyl]-N,N-dimethylpropanamide
CID 82153401
3-chloro-4-[2-(dimethylamino)ethoxy]benzonitrile
CID 60667254
(Z)-3-[3-amino-4-[2-(dimethylamino)ethoxy]phenyl]-N-[2-(dimethylamino)ethyl]prop-2-enamide
CID 94759712
2-methylpropyl 3-amino-4-[2-(dimethylamino)ethoxy]benzoate
CID 82057399
3-bromo-8-[2-(dimethylamino)ethoxy]quinolin-5-amine
CID 106949847

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline?
The IUPAC name of 2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline (CID 69338150) is 2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline.
What is the SMILES notation for 2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline?
The canonical SMILES for 2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline is CN(C)CCOc1ccc(C#C[Si](C)(C)C)cc1N.
What is the InChIKey of 2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline?
The InChIKey is XPPWQWQPVZQKAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OSi/c1-17(2)9-10-18-15-7-6-13(12-14(15)16)8-11-19(3,4)5/h6-7,12H,9-10,16H2,1-5H3.
What are the key properties of 2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline?
2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline has a molecular weight of 276.46 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethoxy]-5-(2-trimethylsilylethynyl)aniline is sourced from PubChem (CID 69338150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).