N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine

C10H20N2O2 — CID 105364804

IUPACN-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine
SMILESCOCCONC1CCN2CCC1C2
InChIInChI=1S/C10H20N2O2/c1-13-6-7-14-11-10-3-5-12-4-2-9(10)8-12/h9-11H,2-8H2,1H3
InChIKeyOSPCTOWYNZGEND-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.25
Rot. Bonds5

About N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine

N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine (PubChem CID 105364804) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine.

Molecular Properties

Compound NameN-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine
PubChem CID105364804
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine
SMILESCOCCONC1CCN2CCC1C2
InChIInChI=1S/C10H20N2O2/c1-13-6-7-14-11-10-3-5-12-4-2-9(10)8-12/h9-11H,2-8H2,1H3
InChIKeyOSPCTOWYNZGEND-UHFFFAOYSA-N
XLogP0.25
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine?
The IUPAC name of N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine (CID 105364804) is N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine.
What is the SMILES notation for N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine?
The canonical SMILES for N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine is COCCONC1CCN2CCC1C2.
What is the InChIKey of N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine?
The InChIKey is OSPCTOWYNZGEND-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-13-6-7-14-11-10-3-5-12-4-2-9(10)8-12/h9-11H,2-8H2,1H3.
What are the key properties of N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine?
N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine has a molecular weight of 200.28 g/mol, XLogP of 0.25, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethoxy)-1-azabicyclo[3.2.1]octan-4-amine is sourced from PubChem (CID 105364804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).