N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine

C13H32N2O3Si — CID 163209900

IUPACN',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine
SMILESCCN(CC)CCN(C)CCC[Si](OC)(OC)OC
InChIInChI=1S/C13H32N2O3Si/c1-7-15(8-2)12-11-14(3)10-9-13-19(16-4,17-5)18-6/h7-13H2,1-6H3
InChIKeyDWQSYDISVNPDQR-UHFFFAOYSA-N
MW292.50 g/mol
LogP1.53
Rot. Bonds12

About N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine

N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine (PubChem CID 163209900) has the molecular formula C13H32N2O3Si and a molecular weight of 292.50 g/mol. Its IUPAC name is N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine
PubChem CID163209900
Molecular FormulaC13H32N2O3Si
Molecular Weight292.50 g/mol
Exact Mass292.22
IUPAC NameN',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine
SMILESCCN(CC)CCN(C)CCC[Si](OC)(OC)OC
InChIInChI=1S/C13H32N2O3Si/c1-7-15(8-2)12-11-14(3)10-9-13-19(16-4,17-5)18-6/h7-13H2,1-6H3
InChIKeyDWQSYDISVNPDQR-UHFFFAOYSA-N
XLogP1.53
TPSA34.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.50
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-[3-(diethylamino)propyl]-N,N-diethyl-N'-(3-trimethoxysilylpropyl)propane-1,3-diamine
CID 140647739
N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide
CID 174161924
N-methylsulfonyl-N-[2-[methyl(3-trimethoxysilylpropyl)amino]ethyl]methanesulfonamide
CID 139973982
N,N-diethyl-2-(2-trimethoxysilylethoxy)ethanamine
CID 90074439
3-[methyl(3-trimethoxysilylpropyl)amino]propane-1-sulfonic acid
CID 46830547
1-deuterio-N-ethyl-N-methyl-3-trimethoxysilylpropan-1-amine
CID 175714335
4-[3-(diethylamino)propyl]-N,N,N',N'-tetraethyl-4-(2-trimethoxysilylethyl)heptane-1,7-diamine
CID 140647245
2-[bis(3-trimethoxysilylpropyl)amino]ethanol;3-[diethoxy(methoxy)silyl]-N-methyl-N-(3-triethoxysilylpropyl)propan-1-amine;2-[3-[diethoxy(methoxy)silyl]propyl-(3-triethoxysilylpropyl)amino]ethanol;N-methyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;3-triethoxysilyl-N-(3-triethoxysilylpropyl)propan-1-amine;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
CID 165038750
3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-dimethoxysilyl]oxy-methoxysilyl]oxy-dimethoxysilyl]-N,N-dimethylpropan-1-amine
CID 171623488
N,N-dimethyl-3-trimethoxysilylpropan-1-amine;3-trimethoxysilylpropan-1-amine
CID 87575509
dicopper;dioxidanium;bis(N,N,N',N'-tetraethylethane-1,2-diamine)
CID 4558005
N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
CID 162116460

Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine?
The IUPAC name of N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine (CID 163209900) is N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine?
The canonical SMILES for N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine is CCN(CC)CCN(C)CCC[Si](OC)(OC)OC.
What is the InChIKey of N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine?
The InChIKey is DWQSYDISVNPDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H32N2O3Si/c1-7-15(8-2)12-11-14(3)10-9-13-19(16-4,17-5)18-6/h7-13H2,1-6H3.
What are the key properties of N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine?
N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine has a molecular weight of 292.50 g/mol, XLogP of 1.53, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-methyl-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine is sourced from PubChem (CID 163209900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).