cyclohexen-1-amine;triethoxy(propyl)silane

C15H33NO3Si — CID 175073818

IUPACcyclohexen-1-amine;triethoxy(propyl)silane
SMILESCCC[Si](OCC)(OCC)OCC.NC1=CCCCC1
InChIInChI=1S/C9H22O3Si.C6H11N/c1-5-9-13(10-6-2,11-7-3)12-8-4;7-6-4-2-1-3-5-6/h5-9H2,1-4H3;4H,1-3,5,7H2
InChIKeyUECVUPOTBUDZDG-UHFFFAOYSA-N
MW303.52 g/mol
LogP3.85
Rot. Bonds8

About cyclohexen-1-amine;triethoxy(propyl)silane

cyclohexen-1-amine;triethoxy(propyl)silane (PubChem CID 175073818) has the molecular formula C15H33NO3Si and a molecular weight of 303.52 g/mol. Its IUPAC name is cyclohexen-1-amine;triethoxy(propyl)silane.

Molecular Properties

Compound Namecyclohexen-1-amine;triethoxy(propyl)silane
PubChem CID175073818
Molecular FormulaC15H33NO3Si
Molecular Weight303.52 g/mol
Exact Mass303.22
IUPAC Namecyclohexen-1-amine;triethoxy(propyl)silane
SMILESCCC[Si](OCC)(OCC)OCC.NC1=CCCCC1
InChIInChI=1S/C9H22O3Si.C6H11N/c1-5-9-13(10-6-2,11-7-3)12-8-4;7-6-4-2-1-3-5-6/h5-9H2,1-4H3;4H,1-3,5,7H2
InChIKeyUECVUPOTBUDZDG-UHFFFAOYSA-N
XLogP3.85
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.52
LogP ≤ 53.85
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 cyclohexen-1-amine;triethoxy(propyl)silane?
The IUPAC name of cyclohexen-1-amine;triethoxy(propyl)silane (CID 175073818) is cyclohexen-1-amine;triethoxy(propyl)silane.
What is the SMILES notation for cyclohexen-1-amine;triethoxy(propyl)silane?
The canonical SMILES for cyclohexen-1-amine;triethoxy(propyl)silane is CCC[Si](OCC)(OCC)OCC.NC1=CCCCC1.
What is the InChIKey of cyclohexen-1-amine;triethoxy(propyl)silane?
The InChIKey is UECVUPOTBUDZDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22O3Si.C6H11N/c1-5-9-13(10-6-2,11-7-3)12-8-4;7-6-4-2-1-3-5-6/h5-9H2,1-4H3;4H,1-3,5,7H2.
What are the key properties of cyclohexen-1-amine;triethoxy(propyl)silane?
cyclohexen-1-amine;triethoxy(propyl)silane has a molecular weight of 303.52 g/mol, XLogP of 3.85, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-amine;triethoxy(propyl)silane is sourced from PubChem (CID 175073818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).