1-diethoxysilyl-N-ethylbutan-1-amine

C10H25NO2Si — CID 173031845

IUPAC1-diethoxysilyl-N-ethylbutan-1-amine
SMILESCCCC(NCC)[SiH](OCC)OCC
InChIInChI=1S/C10H25NO2Si/c1-5-9-10(11-6-2)14(12-7-3)13-8-4/h10-11,14H,5-9H2,1-4H3
InChIKeyNHTNOCZDVCNDSH-UHFFFAOYSA-N
MW219.40 g/mol
LogP1.60
Rot. Bonds9

About 1-diethoxysilyl-N-ethylbutan-1-amine

1-diethoxysilyl-N-ethylbutan-1-amine (PubChem CID 173031845) has the molecular formula C10H25NO2Si and a molecular weight of 219.40 g/mol. Its IUPAC name is 1-diethoxysilyl-N-ethylbutan-1-amine.

Molecular Properties

Compound Name1-diethoxysilyl-N-ethylbutan-1-amine
PubChem CID173031845
Molecular FormulaC10H25NO2Si
Molecular Weight219.40 g/mol
Exact Mass219.17
IUPAC Name1-diethoxysilyl-N-ethylbutan-1-amine
SMILESCCCC(NCC)[SiH](OCC)OCC
InChIInChI=1S/C10H25NO2Si/c1-5-9-10(11-6-2)14(12-7-3)13-8-4/h10-11,14H,5-9H2,1-4H3
InChIKeyNHTNOCZDVCNDSH-UHFFFAOYSA-N
XLogP1.60
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.40
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-diethoxysilyl-N-ethylbutan-1-amine?
The IUPAC name of 1-diethoxysilyl-N-ethylbutan-1-amine (CID 173031845) is 1-diethoxysilyl-N-ethylbutan-1-amine.
What is the SMILES notation for 1-diethoxysilyl-N-ethylbutan-1-amine?
The canonical SMILES for 1-diethoxysilyl-N-ethylbutan-1-amine is CCCC(NCC)[SiH](OCC)OCC.
What is the InChIKey of 1-diethoxysilyl-N-ethylbutan-1-amine?
The InChIKey is NHTNOCZDVCNDSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25NO2Si/c1-5-9-10(11-6-2)14(12-7-3)13-8-4/h10-11,14H,5-9H2,1-4H3.
What are the key properties of 1-diethoxysilyl-N-ethylbutan-1-amine?
1-diethoxysilyl-N-ethylbutan-1-amine has a molecular weight of 219.40 g/mol, XLogP of 1.60, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-diethoxysilyl-N-ethylbutan-1-amine is sourced from PubChem (CID 173031845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).