N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine

C8H16N2O — CID 170122043

IUPACN-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine
SMILESCNC(C)N1CC2CC1CO2
InChIInChI=1S/C8H16N2O/c1-6(9-2)10-4-8-3-7(10)5-11-8/h6-9H,3-5H2,1-2H3
InChIKeyBWCZDHYUEYIIJE-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.02
Rot. Bonds2

About N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine

N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine (PubChem CID 170122043) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine
PubChem CID170122043
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine
SMILESCNC(C)N1CC2CC1CO2
InChIInChI=1S/C8H16N2O/c1-6(9-2)10-4-8-3-7(10)5-11-8/h6-9H,3-5H2,1-2H3
InChIKeyBWCZDHYUEYIIJE-UHFFFAOYSA-N
XLogP0.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine 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-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine?
The IUPAC name of N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine (CID 170122043) is N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine.
What is the SMILES notation for N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine?
The canonical SMILES for N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine is CNC(C)N1CC2CC1CO2.
What is the InChIKey of N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine?
The InChIKey is BWCZDHYUEYIIJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-6(9-2)10-4-8-3-7(10)5-11-8/h6-9H,3-5H2,1-2H3.
What are the key properties of N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine?
N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine has a molecular weight of 156.23 g/mol, XLogP of 0.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethanamine is sourced from PubChem (CID 170122043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).