N-(1-triethoxysilylpropyl)cyclohexanamine

C15H33NO3Si — CID 19973325

IUPACN-(1-triethoxysilylpropyl)cyclohexanamine
SMILESCCO[Si](OCC)(OCC)C(CC)NC1CCCCC1
InChIInChI=1S/C15H33NO3Si/c1-5-15(16-14-12-10-9-11-13-14)20(17-6-2,18-7-3)19-8-4/h14-16H,5-13H2,1-4H3
InChIKeyFWQVCCGNCMNDKE-UHFFFAOYSA-N
MW303.52 g/mol
LogP3.27
Rot. Bonds10

About N-(1-triethoxysilylpropyl)cyclohexanamine

N-(1-triethoxysilylpropyl)cyclohexanamine (PubChem CID 19973325) has the molecular formula C15H33NO3Si and a molecular weight of 303.52 g/mol. Its IUPAC name is N-(1-triethoxysilylpropyl)cyclohexanamine.

Molecular Properties

Compound NameN-(1-triethoxysilylpropyl)cyclohexanamine
PubChem CID19973325
Molecular FormulaC15H33NO3Si
Molecular Weight303.52 g/mol
Exact Mass303.22
IUPAC NameN-(1-triethoxysilylpropyl)cyclohexanamine
SMILESCCO[Si](OCC)(OCC)C(CC)NC1CCCCC1
InChIInChI=1S/C15H33NO3Si/c1-5-15(16-14-12-10-9-11-13-14)20(17-6-2,18-7-3)19-8-4/h14-16H,5-13H2,1-4H3
InChIKeyFWQVCCGNCMNDKE-UHFFFAOYSA-N
XLogP3.27
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.52
LogP ≤ 53.27
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 N-(1-triethoxysilylpropyl)cyclohexanamine?
The IUPAC name of N-(1-triethoxysilylpropyl)cyclohexanamine (CID 19973325) is N-(1-triethoxysilylpropyl)cyclohexanamine.
What is the SMILES notation for N-(1-triethoxysilylpropyl)cyclohexanamine?
The canonical SMILES for N-(1-triethoxysilylpropyl)cyclohexanamine is CCO[Si](OCC)(OCC)C(CC)NC1CCCCC1.
What is the InChIKey of N-(1-triethoxysilylpropyl)cyclohexanamine?
The InChIKey is FWQVCCGNCMNDKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO3Si/c1-5-15(16-14-12-10-9-11-13-14)20(17-6-2,18-7-3)19-8-4/h14-16H,5-13H2,1-4H3.
What are the key properties of N-(1-triethoxysilylpropyl)cyclohexanamine?
N-(1-triethoxysilylpropyl)cyclohexanamine has a molecular weight of 303.52 g/mol, XLogP of 3.27, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-triethoxysilylpropyl)cyclohexanamine is sourced from PubChem (CID 19973325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).