N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane

C18H47NO2Si3 — CID 173005166

IUPACN,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane
SMILESCCCCN([Si](CC)(CC)CC)[Si](CC)(CC)CC.CO[SiH2]OC
InChIInChI=1S/C16H39NSi2.C2H8O2Si/c1-8-15-16-17(18(9-2,10-3)11-4)19(12-5,13-6)14-7;1-3-5-4-2/h8-16H2,1-7H3;5H2,1-2H3
InChIKeyQTWMQXJZAJMRKE-UHFFFAOYSA-N
MW393.84 g/mol
LogP5.38
Rot. Bonds13

About N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane

N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane (PubChem CID 173005166) has the molecular formula C18H47NO2Si3 and a molecular weight of 393.84 g/mol. Its IUPAC name is N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane.

Molecular Properties

Compound NameN,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane
PubChem CID173005166
Molecular FormulaC18H47NO2Si3
Molecular Weight393.84 g/mol
Exact Mass393.29
IUPAC NameN,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane
SMILESCCCCN([Si](CC)(CC)CC)[Si](CC)(CC)CC.CO[SiH2]OC
InChIInChI=1S/C16H39NSi2.C2H8O2Si/c1-8-15-16-17(18(9-2,10-3)11-4)19(12-5,13-6)14-7;1-3-5-4-2/h8-16H2,1-7H3;5H2,1-2H3
InChIKeyQTWMQXJZAJMRKE-UHFFFAOYSA-N
XLogP5.38
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.84
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N-bis(triethylsilyl)butan-1-amine;diethoxysilane
CID 173005185
N,N-bis(triethylsilyl)dodecan-1-amine
CID 151814619
dimethoxysilane;N-methyl-N-trimethylsilylbutan-1-amine
CID 173056077
dibutyltin;dimethoxysilane
CID 157060986
N-butyl-N-dimethoxysilylbutan-1-amine
CID 154276782
N,N-dimethylbutan-1-amine;dihydrochloride
CID 174248401
dimethoxysilane;hydrobromide
CID 172733949
dimethoxysilane;dihydrobromide
CID 173397355
dimethoxysilane;hydron
CID 174727908
N,N-dimethylbutan-1-amine;ethane;methane
CID 142050981
methoxymethane;pentane
CID 87151149
N,N-bis[(dipropylamino)-di(propan-2-yl)silyl]butan-1-amine
CID 156755995

Frequently Asked Questions

What is the IUPAC name of N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane?
The IUPAC name of N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane (CID 173005166) is N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane.
What is the SMILES notation for N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane?
The canonical SMILES for N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane is CCCCN([Si](CC)(CC)CC)[Si](CC)(CC)CC.CO[SiH2]OC.
What is the InChIKey of N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane?
The InChIKey is QTWMQXJZAJMRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H39NSi2.C2H8O2Si/c1-8-15-16-17(18(9-2,10-3)11-4)19(12-5,13-6)14-7;1-3-5-4-2/h8-16H2,1-7H3;5H2,1-2H3.
What are the key properties of N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane?
N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane has a molecular weight of 393.84 g/mol, XLogP of 5.38, 13 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(triethylsilyl)butan-1-amine;dimethoxysilane is sourced from PubChem (CID 173005166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).