3-ethyl-1-trimethoxysilylpentan-3-amine

C10H25NO3Si — CID 21018739

IUPAC3-ethyl-1-trimethoxysilylpentan-3-amine
SMILESCCC(N)(CC)CC[Si](OC)(OC)OC
InChIInChI=1S/C10H25NO3Si/c1-6-10(11,7-2)8-9-15(12-3,13-4)14-5/h6-9,11H2,1-5H3
InChIKeyUJWHZMCOVUUNAB-UHFFFAOYSA-N
MW235.40 g/mol
LogP1.77
Rot. Bonds8

About 3-ethyl-1-trimethoxysilylpentan-3-amine

3-ethyl-1-trimethoxysilylpentan-3-amine (PubChem CID 21018739) has the molecular formula C10H25NO3Si and a molecular weight of 235.40 g/mol. Its IUPAC name is 3-ethyl-1-trimethoxysilylpentan-3-amine.

Molecular Properties

Compound Name3-ethyl-1-trimethoxysilylpentan-3-amine
PubChem CID21018739
Molecular FormulaC10H25NO3Si
Molecular Weight235.40 g/mol
Exact Mass235.16
IUPAC Name3-ethyl-1-trimethoxysilylpentan-3-amine
SMILESCCC(N)(CC)CC[Si](OC)(OC)OC
InChIInChI=1S/C10H25NO3Si/c1-6-10(11,7-2)8-9-15(12-3,13-4)14-5/h6-9,11H2,1-5H3
InChIKeyUJWHZMCOVUUNAB-UHFFFAOYSA-N
XLogP1.77
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.40
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 3-ethyl-1-trimethoxysilylpentan-3-amine?
The IUPAC name of 3-ethyl-1-trimethoxysilylpentan-3-amine (CID 21018739) is 3-ethyl-1-trimethoxysilylpentan-3-amine.
What is the SMILES notation for 3-ethyl-1-trimethoxysilylpentan-3-amine?
The canonical SMILES for 3-ethyl-1-trimethoxysilylpentan-3-amine is CCC(N)(CC)CC[Si](OC)(OC)OC.
What is the InChIKey of 3-ethyl-1-trimethoxysilylpentan-3-amine?
The InChIKey is UJWHZMCOVUUNAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25NO3Si/c1-6-10(11,7-2)8-9-15(12-3,13-4)14-5/h6-9,11H2,1-5H3.
What are the key properties of 3-ethyl-1-trimethoxysilylpentan-3-amine?
3-ethyl-1-trimethoxysilylpentan-3-amine has a molecular weight of 235.40 g/mol, XLogP of 1.77, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-trimethoxysilylpentan-3-amine is sourced from PubChem (CID 21018739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).