8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane

C16H28N2O — CID 56625364

IUPAC8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane
SMILESCN1C2CCC1CC(OC1CC3CCC(C1)N3C)C2
InChIInChI=1S/C16H28N2O/c1-17-11-3-4-12(17)8-15(7-11)19-16-9-13-5-6-14(10-16)18(13)2/h11-16H,3-10H2,1-2H3
InChIKeyQYAJIMYDKWUOKE-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.25
Rot. Bonds2

About 8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane

8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane (PubChem CID 56625364) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane
PubChem CID56625364
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane
SMILESCN1C2CCC1CC(OC1CC3CCC(C1)N3C)C2
InChIInChI=1S/C16H28N2O/c1-17-11-3-4-12(17)8-15(7-11)19-16-9-13-5-6-14(10-16)18(13)2/h11-16H,3-10H2,1-2H3
InChIKeyQYAJIMYDKWUOKE-UHFFFAOYSA-N
XLogP2.25
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane with MolForge

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Related Compounds

Bis(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) but-2-ynedioate
CID 22615909
bis[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] but-2-ynedioate
CID 70248831
3-Methoxyspiro[8-azoniabicyclo[3.2.1]octane-8,1'-azolidin-1-ium]
CID 89333123
(1R,5R)-8-methyl-1-[[(1R,5R)-8-methyl-8-azabicyclo[3.2.1]octan-1-yl]oxy]-8-azabicyclo[3.2.1]octane
CID 141455234
(1S,5R)-8-methyl-3-[2-[(1S,5R)-3-propan-2-yloxy-8-azabicyclo[3.2.1]octan-8-yl]ethoxy]-8-azabicyclo[3.2.1]octane
CID 155119969
(1S,5R)-3-methoxy-8-[2-methyl-2-[[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]oxy]propyl]-8-azabicyclo[3.2.1]octane
CID 155120170
Butane;diiodovanadium;methane;8-methyl-8-azabicyclo[3.2.1]octan-3-ol;8-methyl-3-propoxy-8-azabicyclo[3.2.1]octane;triiodovanadium
CID 158544698
Butane;diiodovanadium;methane;8-methyl-8-azabicyclo[3.2.1]octan-3-ol;8-methyl-3-propoxy-8-azabicyclo[3.2.1]octane
CID 159532638
(6R)-8-methyl-8-azabicyclo[3.2.1]octan-6-ol;(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-ol
CID 160181347
(5R)-8-methyl-8-azabicyclo[3.2.1]octan-6-ol
CID 160181348
(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-ol
CID 160247399
3-Ethoxy-8-[3-methyl-3-[[8-(oxetan-3-yl)-8-azabicyclo[3.2.1]octan-3-yl]oxy]butyl]-8-azabicyclo[3.2.1]octane
CID 167292036

Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane?
The IUPAC name of 8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane (CID 56625364) is 8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane is CN1C2CCC1CC(OC1CC3CCC(C1)N3C)C2.
What is the InChIKey of 8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane?
The InChIKey is QYAJIMYDKWUOKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-17-11-3-4-12(17)8-15(7-11)19-16-9-13-5-6-14(10-16)18(13)2/h11-16H,3-10H2,1-2H3.
What are the key properties of 8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane?
8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane has a molecular weight of 264.41 g/mol, XLogP of 2.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 56625364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).