N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline

C24H47NO2Si2 — CID 10694288

IUPACN,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline
SMILESCC(C)(C)[Si](C)(C)OCCCN(CCCO[Si](C)(C)C(C)(C)C)c1ccccc1
InChIInChI=1S/C24H47NO2Si2/c1-23(2,3)28(7,8)26-20-14-18-25(22-16-12-11-13-17-22)19-15-21-27-29(9,10)24(4,5)6/h11-13,16-17H,14-15,18-21H2,1-10H3
InChIKeyLDXSOYWWPMRZLA-UHFFFAOYSA-N
MW437.82 g/mol
LogP7.32
Rot. Bonds11

About N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline

N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline (PubChem CID 10694288) has the molecular formula C24H47NO2Si2 and a molecular weight of 437.82 g/mol. Its IUPAC name is N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline.

Molecular Properties

Compound NameN,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline
PubChem CID10694288
Molecular FormulaC24H47NO2Si2
Molecular Weight437.82 g/mol
Exact Mass437.31
IUPAC NameN,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline
SMILESCC(C)(C)[Si](C)(C)OCCCN(CCCO[Si](C)(C)C(C)(C)C)c1ccccc1
InChIInChI=1S/C24H47NO2Si2/c1-23(2,3)28(7,8)26-20-14-18-25(22-16-12-11-13-17-22)19-15-21-27-29(9,10)24(4,5)6/h11-13,16-17H,14-15,18-21H2,1-10H3
InChIKeyLDXSOYWWPMRZLA-UHFFFAOYSA-N
XLogP7.32
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.82
LogP ≤ 57.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

tert-butyl N-[4-[tert-butyl(dimethyl)silyl]oxybutyl]-N-phenylcarbamate
CID 67539980
tert-butyl-[4-[dimethyl(phenyl)silyl]butoxy]-dimethylsilane
CID 102153241
tert-butyl-dimethyl-(2-phenylethoxy)silane
CID 11128311
2-[tert-butyl(dimethyl)silyl]oxy-N,N-diphenylacetamide
CID 24809397
tert-butyl-dimethyl-(6-trityloxyhexoxy)silane
CID 16753413
N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-ethyl-3-methylaniline
CID 91719512
N,N-bis[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-(2-trimethylsilylethynyl)aniline
CID 59370991
tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxypentyl]-diphenylsilane
CID 11293613
4-butyl-N-[4-[2-[3-[tert-butyl(dimethyl)silyl]oxypropoxy]ethyl]phenyl]-N-phenylaniline
CID 11800072
3-[tert-butyl(dimethyl)silyl]oxypropyl N-phenylcarbamate
CID 177244740
tert-butyl-dimethyl-(2-phenylsulfanylethoxy)silane
CID 11346217
tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexoxy]-dimethylsilane
CID 6430202

Frequently Asked Questions

What is the IUPAC name of N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline?
The IUPAC name of N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline (CID 10694288) is N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline.
What is the SMILES notation for N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline?
The canonical SMILES for N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline is CC(C)(C)[Si](C)(C)OCCCN(CCCO[Si](C)(C)C(C)(C)C)c1ccccc1.
What is the InChIKey of N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline?
The InChIKey is LDXSOYWWPMRZLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H47NO2Si2/c1-23(2,3)28(7,8)26-20-14-18-25(22-16-12-11-13-17-22)19-15-21-27-29(9,10)24(4,5)6/h11-13,16-17H,14-15,18-21H2,1-10H3.
What are the key properties of N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline?
N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline has a molecular weight of 437.82 g/mol, XLogP of 7.32, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline is sourced from PubChem (CID 10694288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).