6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane

C15H26N2O2 — CID 3056551

IUPAC6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane
SMILESC1CC2CN(CCCN3CC4CCCC3O4)C(C1)O2
InChIInChI=1S/C15H26N2O2/c1-4-12-10-16(14(6-1)18-12)8-3-9-17-11-13-5-2-7-15(17)19-13/h12-15H,1-11H2
InChIKeyHDTDXHPUJRWXFT-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.80
Rot. Bonds4

About 6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane

6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane (PubChem CID 3056551) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane
PubChem CID3056551
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane
SMILESC1CC2CN(CCCN3CC4CCCC3O4)C(C1)O2
InChIInChI=1S/C15H26N2O2/c1-4-12-10-16(14(6-1)18-12)8-3-9-17-11-13-5-2-7-15(17)19-13/h12-15H,1-11H2
InChIKeyHDTDXHPUJRWXFT-UHFFFAOYSA-N
XLogP1.80
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane?
The IUPAC name of 6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane (CID 3056551) is 6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane.
What is the SMILES notation for 6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane?
The canonical SMILES for 6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane is C1CC2CN(CCCN3CC4CCCC3O4)C(C1)O2.
What is the InChIKey of 6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane?
The InChIKey is HDTDXHPUJRWXFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-4-12-10-16(14(6-1)18-12)8-3-9-17-11-13-5-2-7-15(17)19-13/h12-15H,1-11H2.
What are the key properties of 6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane?
6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane has a molecular weight of 266.38 g/mol, XLogP of 1.80, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(8-oxa-6-azabicyclo[3.2.1]octan-6-yl)propyl]-8-oxa-6-azabicyclo[3.2.1]octane is sourced from PubChem (CID 3056551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).