N-(8-trihydroxysilyloctyl)cyclopropanamine

C11H25NO3Si — CID 69079591

IUPACN-(8-trihydroxysilyloctyl)cyclopropanamine
SMILESO[Si](O)(O)CCCCCCCCNC1CC1
InChIInChI=1S/C11H25NO3Si/c13-16(14,15)10-6-4-2-1-3-5-9-12-11-7-8-11/h11-15H,1-10H2
InChIKeyQDUQSTIQEARSSA-UHFFFAOYSA-N
MW247.41 g/mol
LogP0.99
Rot. Bonds10

About N-(8-trihydroxysilyloctyl)cyclopropanamine

N-(8-trihydroxysilyloctyl)cyclopropanamine (PubChem CID 69079591) has the molecular formula C11H25NO3Si and a molecular weight of 247.41 g/mol. Its IUPAC name is N-(8-trihydroxysilyloctyl)cyclopropanamine.

Molecular Properties

Compound NameN-(8-trihydroxysilyloctyl)cyclopropanamine
PubChem CID69079591
Molecular FormulaC11H25NO3Si
Molecular Weight247.41 g/mol
Exact Mass247.16
IUPAC NameN-(8-trihydroxysilyloctyl)cyclopropanamine
SMILESO[Si](O)(O)CCCCCCCCNC1CC1
InChIInChI=1S/C11H25NO3Si/c13-16(14,15)10-6-4-2-1-3-5-9-12-11-7-8-11/h11-15H,1-10H2
InChIKeyQDUQSTIQEARSSA-UHFFFAOYSA-N
XLogP0.99
TPSA72.72 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.41
LogP ≤ 50.99
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(8-trihydroxysilyloctyl)cyclopropanamine?
The IUPAC name of N-(8-trihydroxysilyloctyl)cyclopropanamine (CID 69079591) is N-(8-trihydroxysilyloctyl)cyclopropanamine.
What is the SMILES notation for N-(8-trihydroxysilyloctyl)cyclopropanamine?
The canonical SMILES for N-(8-trihydroxysilyloctyl)cyclopropanamine is O[Si](O)(O)CCCCCCCCNC1CC1.
What is the InChIKey of N-(8-trihydroxysilyloctyl)cyclopropanamine?
The InChIKey is QDUQSTIQEARSSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3Si/c13-16(14,15)10-6-4-2-1-3-5-9-12-11-7-8-11/h11-15H,1-10H2.
What are the key properties of N-(8-trihydroxysilyloctyl)cyclopropanamine?
N-(8-trihydroxysilyloctyl)cyclopropanamine has a molecular weight of 247.41 g/mol, XLogP of 0.99, 10 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-trihydroxysilyloctyl)cyclopropanamine is sourced from PubChem (CID 69079591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).