N-cyclopentyl-N-trimethoxysilylcyclopentanamine

C13H27NO3Si — CID 66628584

IUPACN-cyclopentyl-N-trimethoxysilylcyclopentanamine
SMILESCO[Si](OC)(OC)N(C1CCCC1)C1CCCC1
InChIInChI=1S/C13H27NO3Si/c1-15-18(16-2,17-3)14(12-8-4-5-9-12)13-10-6-7-11-13/h12-13H,4-11H2,1-3H3
InChIKeyTUUNYMHSHXABRH-UHFFFAOYSA-N
MW273.45 g/mol
LogP2.55
Rot. Bonds6

About N-cyclopentyl-N-trimethoxysilylcyclopentanamine

N-cyclopentyl-N-trimethoxysilylcyclopentanamine (PubChem CID 66628584) has the molecular formula C13H27NO3Si and a molecular weight of 273.45 g/mol. Its IUPAC name is N-cyclopentyl-N-trimethoxysilylcyclopentanamine.

Molecular Properties

Compound NameN-cyclopentyl-N-trimethoxysilylcyclopentanamine
PubChem CID66628584
Molecular FormulaC13H27NO3Si
Molecular Weight273.45 g/mol
Exact Mass273.18
IUPAC NameN-cyclopentyl-N-trimethoxysilylcyclopentanamine
SMILESCO[Si](OC)(OC)N(C1CCCC1)C1CCCC1
InChIInChI=1S/C13H27NO3Si/c1-15-18(16-2,17-3)14(12-8-4-5-9-12)13-10-6-7-11-13/h12-13H,4-11H2,1-3H3
InChIKeyTUUNYMHSHXABRH-UHFFFAOYSA-N
XLogP2.55
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.45
LogP ≤ 52.55
H-Bond Donors ≤ 50
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-cyclopentyl-N-trimethoxysilylcyclopentanamine?
The IUPAC name of N-cyclopentyl-N-trimethoxysilylcyclopentanamine (CID 66628584) is N-cyclopentyl-N-trimethoxysilylcyclopentanamine.
What is the SMILES notation for N-cyclopentyl-N-trimethoxysilylcyclopentanamine?
The canonical SMILES for N-cyclopentyl-N-trimethoxysilylcyclopentanamine is CO[Si](OC)(OC)N(C1CCCC1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-trimethoxysilylcyclopentanamine?
The InChIKey is TUUNYMHSHXABRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO3Si/c1-15-18(16-2,17-3)14(12-8-4-5-9-12)13-10-6-7-11-13/h12-13H,4-11H2,1-3H3.
What are the key properties of N-cyclopentyl-N-trimethoxysilylcyclopentanamine?
N-cyclopentyl-N-trimethoxysilylcyclopentanamine has a molecular weight of 273.45 g/mol, XLogP of 2.55, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-trimethoxysilylcyclopentanamine is sourced from PubChem (CID 66628584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).