2-oxa-7-azabicyclo[3.3.2]decane

C8H15NO — CID 118209690

IUPAC2-oxa-7-azabicyclo[3.3.2]decane
SMILESC1CC2CCC(CNC2)O1
InChIInChI=1S/C8H15NO/c1-2-8-6-9-5-7(1)3-4-10-8/h7-9H,1-6H2
InChIKeyBLUZPAFBZFBFOD-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.77
Rot. Bonds

About 2-oxa-7-azabicyclo[3.3.2]decane

2-oxa-7-azabicyclo[3.3.2]decane (PubChem CID 118209690) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-oxa-7-azabicyclo[3.3.2]decane.

Molecular Properties

Compound Name2-oxa-7-azabicyclo[3.3.2]decane
PubChem CID118209690
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-oxa-7-azabicyclo[3.3.2]decane
SMILESC1CC2CCC(CNC2)O1
InChIInChI=1S/C8H15NO/c1-2-8-6-9-5-7(1)3-4-10-8/h7-9H,1-6H2
InChIKeyBLUZPAFBZFBFOD-UHFFFAOYSA-N
XLogP0.77
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-oxa-7-azabicyclo[3.3.2]decane 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 2-oxa-7-azabicyclo[3.3.2]decane?
The IUPAC name of 2-oxa-7-azabicyclo[3.3.2]decane (CID 118209690) is 2-oxa-7-azabicyclo[3.3.2]decane.
What is the SMILES notation for 2-oxa-7-azabicyclo[3.3.2]decane?
The canonical SMILES for 2-oxa-7-azabicyclo[3.3.2]decane is C1CC2CCC(CNC2)O1.
What is the InChIKey of 2-oxa-7-azabicyclo[3.3.2]decane?
The InChIKey is BLUZPAFBZFBFOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-2-8-6-9-5-7(1)3-4-10-8/h7-9H,1-6H2.
What are the key properties of 2-oxa-7-azabicyclo[3.3.2]decane?
2-oxa-7-azabicyclo[3.3.2]decane has a molecular weight of 141.21 g/mol, XLogP of 0.77, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxa-7-azabicyclo[3.3.2]decane is sourced from PubChem (CID 118209690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).