N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine

C21H49NO7Si2 — CID 162775125

IUPACN-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine
SMILESCCO[Si](CCCN(CCC[Si](OCC)(OCC)OCC)CCOC)(OCC)OCC
InChIInChI=1S/C21H49NO7Si2/c1-8-24-30(25-9-2,26-10-3)20-14-16-22(18-19-23-7)17-15-21-31(27-11-4,28-12-5)29-13-6/h8-21H2,1-7H3
InChIKeyDIUDPVMIODYKDZ-UHFFFAOYSA-N
MW483.80 g/mol
LogP3.81
Rot. Bonds23

About N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine

N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine (PubChem CID 162775125) has the molecular formula C21H49NO7Si2 and a molecular weight of 483.80 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine
PubChem CID162775125
Molecular FormulaC21H49NO7Si2
Molecular Weight483.80 g/mol
Exact Mass483.30
IUPAC NameN-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine
SMILESCCO[Si](CCCN(CCC[Si](OCC)(OCC)OCC)CCOC)(OCC)OCC
InChIInChI=1S/C21H49NO7Si2/c1-8-24-30(25-9-2,26-10-3)20-14-16-22(18-19-23-7)17-15-21-31(27-11-4,28-12-5)29-13-6/h8-21H2,1-7H3
InChIKeyDIUDPVMIODYKDZ-UHFFFAOYSA-N
XLogP3.81
TPSA67.85 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds23
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500483.80
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

triethoxy(3-methoxypropyl)silane
CID 22712922
N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-(3-triethoxysilylpropyl)propane-1,3-diamine
CID 140647406
2-[2-[2-hydroxyethyl(3-triethoxysilylpropyl)amino]ethyl-(3-triethoxysilylpropyl)amino]ethanol
CID 165406159
2-[3-[diethoxy(methoxy)silyl]propyl-(3-triethoxysilylpropyl)amino]ethanol
CID 159716952
N-ethoxy-N-silyl-3-triethoxysilylpropan-1-amine
CID 173146503
N'-[3-(dipropylamino)propyl]-N,N-dipropyl-N'-(2-triethoxysilylethyl)propane-1,3-diamine
CID 140647743
3-[bis[2-(didodecylamino)ethoxy]-ethoxysilyl]propane-1-thiol
CID 159134516
N-(2-ethoxy-2-methoxyethyl)-N-(2-methoxyethyl)-3-trimethoxysilylpropan-1-amine
CID 142740325
N-[3-[ethyl(dimethoxy)silyl]propyl]-3-methoxy-N-(2-methoxyethyl)propan-1-amine
CID 142740314
N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
CID 162116460
N'-(2-ethoxyethyl)-N'-(2-methoxyethyl)propane-1,3-diamine
CID 55220253
triethoxy(10-triethoxysilyldecyl)silane
CID 14439044

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine?
The IUPAC name of N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine (CID 162775125) is N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine.
What is the SMILES notation for N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine?
The canonical SMILES for N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine is CCO[Si](CCCN(CCC[Si](OCC)(OCC)OCC)CCOC)(OCC)OCC.
What is the InChIKey of N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine?
The InChIKey is DIUDPVMIODYKDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H49NO7Si2/c1-8-24-30(25-9-2,26-10-3)20-14-16-22(18-19-23-7)17-15-21-31(27-11-4,28-12-5)29-13-6/h8-21H2,1-7H3.
What are the key properties of N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine?
N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine has a molecular weight of 483.80 g/mol, XLogP of 3.81, 23 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine is sourced from PubChem (CID 162775125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).