N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine

C19H44N2O3Si — CID 158707795

IUPACN'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine
SMILESCOCCOCCCNCCCCCNCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H44N2O3Si/c1-19(2,3)25(5,6)24-16-14-21-12-9-7-8-11-20-13-10-15-23-18-17-22-4/h20-21H,7-18H2,1-6H3
InChIKeyMTPPESOEKKMDTA-UHFFFAOYSA-N
MW376.66 g/mol
LogP3.41
Rot. Bonds17

About N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine

N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine (PubChem CID 158707795) has the molecular formula C19H44N2O3Si and a molecular weight of 376.66 g/mol. Its IUPAC name is N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine.

Molecular Properties

Compound NameN'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine
PubChem CID158707795
Molecular FormulaC19H44N2O3Si
Molecular Weight376.66 g/mol
Exact Mass376.31
IUPAC NameN'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine
SMILESCOCCOCCCNCCCCCNCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H44N2O3Si/c1-19(2,3)25(5,6)24-16-14-21-12-9-7-8-11-20-13-10-15-23-18-17-22-4/h20-21H,7-18H2,1-6H3
InChIKeyMTPPESOEKKMDTA-UHFFFAOYSA-N
XLogP3.41
TPSA51.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds17
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.66
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-dimethylsilane
CID 91694118
2-[tert-butyl(dimethyl)silyl]oxy-N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]ethanamine
CID 11427595
3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol
CID 156692863
N-[3-(2-methoxyethoxy)propyl]hexan-1-amine
CID 28880105
3-methoxy-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine
CID 104561644
6-bromo-N-[3-(2-methoxyethoxy)propyl]hexan-1-amine
CID 107844046
N-butyl-4-[tert-butyl(dimethyl)silyl]oxybutan-1-amine
CID 146913472
N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine
CID 63492773
3-methoxy-N-[3-(2-methoxyethoxy)propyl]-3-methylbutan-1-amine
CID 106675103
N-[3-(2-methoxyethoxy)propyl]-2-methylpropan-2-amine
CID 62455424
6-[2-(2-methoxyethoxy)ethylamino]hexan-1-ol
CID 107703333
6-chloro-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]hexan-1-amine
CID 114008238

Frequently Asked Questions

What is the IUPAC name of N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine?
The IUPAC name of N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine (CID 158707795) is N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine.
What is the SMILES notation for N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine?
The canonical SMILES for N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine is COCCOCCCNCCCCCNCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine?
The InChIKey is MTPPESOEKKMDTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H44N2O3Si/c1-19(2,3)25(5,6)24-16-14-21-12-9-7-8-11-20-13-10-15-23-18-17-22-4/h20-21H,7-18H2,1-6H3.
What are the key properties of N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine?
N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine has a molecular weight of 376.66 g/mol, XLogP of 3.41, 17 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-[3-(2-methoxyethoxy)propyl]pentane-1,5-diamine is sourced from PubChem (CID 158707795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).