2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone

C15H26N2O2 — CID 79606856

IUPAC2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)CC2CC3CCC(C2)N3)C(C)CO1
InChIInChI=1S/C15H26N2O2/c1-10-9-19-11(2)8-17(10)15(18)7-12-5-13-3-4-14(6-12)16-13/h10-14,16H,3-9H2,1-2H3
InChIKeyCSBPVNDBLRNQOU-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.54
Rot. Bonds2

About 2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone

2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone (PubChem CID 79606856) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone
PubChem CID79606856
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)CC2CC3CCC(C2)N3)C(C)CO1
InChIInChI=1S/C15H26N2O2/c1-10-9-19-11(2)8-17(10)15(18)7-12-5-13-3-4-14(6-12)16-13/h10-14,16H,3-9H2,1-2H3
InChIKeyCSBPVNDBLRNQOU-UHFFFAOYSA-N
XLogP1.54
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone (CID 79606856) is 2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone is CC1CN(C(=O)CC2CC3CCC(C2)N3)C(C)CO1.
What is the InChIKey of 2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
The InChIKey is CSBPVNDBLRNQOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-10-9-19-11(2)8-17(10)15(18)7-12-5-13-3-4-14(6-12)16-13/h10-14,16H,3-9H2,1-2H3.
What are the key properties of 2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone has a molecular weight of 266.38 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(2,5-dimethylmorpholin-4-yl)ethanone is sourced from PubChem (CID 79606856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).