N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine

C51H123N3O21Si6 — CID 162116459

IUPACN,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
SMILESCCCN(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.CCCN(CCOCCC[Si](OC)(OC)OC)CCOCCC[Si](OC)(OC)OC.CCCOCCN(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC
InChIInChI=1S/C19H45NO8Si2.C17H41NO7Si2.C15H37NO6Si2/c1-8-11-20(12-16-27-14-9-18-29(21-2,22-3)23-4)13-17-28-15-10-19-30(24-5,25-6)26-7;1-8-14-25-15-13-18(11-9-16-26(19-2,20-3)21-4)12-10-17-27(22-5,23-6)24-7;1-8-11-16(12-9-14-23(17-2,18-3)19-4)13-10-15-24(20-5,21-6)22-7/h8-19H2,1-7H3;8-17H2,1-7H3;8-15H2,1-7H3
InChIKeyZGVFKSDDPCAHJV-UHFFFAOYSA-N
MW1283.06 g/mol
LogP6.75
Rot. Bonds57

About N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine

N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine (PubChem CID 162116459) has the molecular formula C51H123N3O21Si6 and a molecular weight of 1283.06 g/mol. Its IUPAC name is N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine.

Molecular Properties

Compound NameN,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
PubChem CID162116459
Molecular FormulaC51H123N3O21Si6
Molecular Weight1283.06 g/mol
Exact Mass1281.73
IUPAC NameN,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
SMILESCCCN(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.CCCN(CCOCCC[Si](OC)(OC)OC)CCOCCC[Si](OC)(OC)OC.CCCOCCN(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC
InChIInChI=1S/C19H45NO8Si2.C17H41NO7Si2.C15H37NO6Si2/c1-8-11-20(12-16-27-14-9-18-29(21-2,22-3)23-4)13-17-28-15-10-19-30(24-5,25-6)26-7;1-8-14-25-15-13-18(11-9-16-26(19-2,20-3)21-4)12-10-17-27(22-5,23-6)24-7;1-8-11-16(12-9-14-23(17-2,18-3)19-4)13-10-15-24(20-5,21-6)22-7/h8-19H2,1-7H3;8-17H2,1-7H3;8-15H2,1-7H3
InChIKeyZGVFKSDDPCAHJV-UHFFFAOYSA-N
XLogP6.75
TPSA203.55 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds57
Heavy Atoms81
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001283.06
LogP ≤ 56.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

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

Analyze N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine with MolForge

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Related Compounds

N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
CID 162116460
N,N-bis(3-trimethoxysilylpropyl)acetamide;N,N-bis(3-trimethoxysilylpropyl)butan-1-amine;N,N-bis(3-trimethoxysilylpropyl)pentan-1-amine;N-(2-ethoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-ethyl-2-(3-trimethoxysilylpropoxy)-N-[2-(3-trimethoxysilylpropoxy)ethyl]ethanamine;N-ethyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
CID 158779944
N'-[3-(diethylamino)propyl]-N,N-diethyl-N'-(3-trimethoxysilylpropyl)propane-1,3-diamine
CID 140647739
3-[propyl(3-trimethoxysilylpropyl)amino]propanoic acid
CID 151472451
trimethoxy-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-octadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]silane
CID 155614579
N,N-diethyl-2-(2-trimethoxysilylethoxy)ethanamine
CID 90074439
N'-(5-aminopentyl)-N'-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]pentane-1,5-diamine
CID 88853551
N'-ethyl-N'-(2-propoxyethyl)propane-1,3-diamine
CID 106450802
N'-[3-(2-methoxyethoxy)propyl]-N'-propylethane-1,2-diamine
CID 103409202
N-butyl-N-(2-hexoxyethyl)butan-1-amine;hydrochloride
CID 131884842
3-bromo-N-ethyl-N-(2-propoxyethyl)propan-1-amine
CID 106457825
N-(2-methoxyethyl)-3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine
CID 162775125

Frequently Asked Questions

What is the IUPAC name of N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine?
The IUPAC name of N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine (CID 162116459) is N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine.
What is the SMILES notation for N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine?
The canonical SMILES for N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine is CCCN(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.CCCN(CCOCCC[Si](OC)(OC)OC)CCOCCC[Si](OC)(OC)OC.CCCOCCN(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.
What is the InChIKey of N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine?
The InChIKey is ZGVFKSDDPCAHJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H45NO8Si2.C17H41NO7Si2.C15H37NO6Si2/c1-8-11-20(12-16-27-14-9-18-29(21-2,22-3)23-4)13-17-28-15-10-19-30(24-5,25-6)26-7;1-8-14-25-15-13-18(11-9-16-26(19-2,20-3)21-4)12-10-17-27(22-5,23-6)24-7;1-8-11-16(12-9-14-23(17-2,18-3)19-4)13-10-15-24(20-5,21-6)22-7/h8-19H2,1-7H3;8-17H2,1-7H3;8-15H2,1-7H3.
What are the key properties of N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine?
N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine has a molecular weight of 1283.06 g/mol, XLogP of 6.75, 57 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine is sourced from PubChem (CID 162116459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).