4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine

C13H31NO2Si — CID 18538179

IUPAC4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine
SMILESCCO[Si](C)(CCC(CC)(CC)CN)OCC
InChIInChI=1S/C13H31NO2Si/c1-6-13(7-2,12-14)10-11-17(5,15-8-3)16-9-4/h6-12,14H2,1-5H3
InChIKeyCJIBCOAIAHBDEL-UHFFFAOYSA-N
MW261.48 g/mol
LogP3.29
Rot. Bonds10

About 4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine

4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine (PubChem CID 18538179) has the molecular formula C13H31NO2Si and a molecular weight of 261.48 g/mol. Its IUPAC name is 4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine.

Molecular Properties

Compound Name4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine
PubChem CID18538179
Molecular FormulaC13H31NO2Si
Molecular Weight261.48 g/mol
Exact Mass261.21
IUPAC Name4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine
SMILESCCO[Si](C)(CCC(CC)(CC)CN)OCC
InChIInChI=1S/C13H31NO2Si/c1-6-13(7-2,12-14)10-11-17(5,15-8-3)16-9-4/h6-12,14H2,1-5H3
InChIKeyCJIBCOAIAHBDEL-UHFFFAOYSA-N
XLogP3.29
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.48
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-ethoxy-2,2-diethylbutan-1-amine
CID 62725698
2,2-diethylbutan-1-amine;hydrochloride
CID 71756050
3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate
CID 160657571
2,2-diethyl-4-[(2-methylpropan-2-yl)oxy]butan-1-amine
CID 112591457
5-[ethoxy(dimethyl)silyl]-2-[3-[ethoxy(dimethyl)silyl]propyl]pentane-1,2-diamine
CID 21285290
[diethoxy(methyl)silyl]methyl-diethoxy-methylsilane
CID 13131406
3-[1-[2,2-bis[1-(3-triethoxysilylpropylsulfanyl)ethoxymethyl]butoxy]ethylsulfanyl]propyl-diethoxy-methylsilane
CID 59408010
diethoxy-methyl-undecylsilane
CID 140884401
O-[2-[diethoxy(methyl)silyl]ethyl] ethanethioate
CID 57259196
diethoxy-methyl-(2-trimethylsilylsulfanylethyl)silane
CID 88867782
2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane
CID 139997357
[diethoxy(methyl)silyl]methanethiol;3-[diethoxy(methyl)silyl]propyl-diethoxy-methylsilane
CID 165005930

Frequently Asked Questions

What is the IUPAC name of 4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine?
The IUPAC name of 4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine (CID 18538179) is 4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine.
What is the SMILES notation for 4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine?
The canonical SMILES for 4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine is CCO[Si](C)(CCC(CC)(CC)CN)OCC.
What is the InChIKey of 4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine?
The InChIKey is CJIBCOAIAHBDEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H31NO2Si/c1-6-13(7-2,12-14)10-11-17(5,15-8-3)16-9-4/h6-12,14H2,1-5H3.
What are the key properties of 4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine?
4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine has a molecular weight of 261.48 g/mol, XLogP of 3.29, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[diethoxy(methyl)silyl]-2,2-diethylbutan-1-amine is sourced from PubChem (CID 18538179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).