2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane

C10H19NO — CID 58479350

IUPAC2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane
SMILESCOC1C(C)CC2CCC1N2C
InChIInChI=1S/C10H19NO/c1-7-6-8-4-5-9(11(8)2)10(7)12-3/h7-10H,4-6H2,1-3H3
InChIKeyUKTKIPUQRIONMY-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.50
Rot. Bonds1

About 2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane

2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane (PubChem CID 58479350) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane
PubChem CID58479350
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane
SMILESCOC1C(C)CC2CCC1N2C
InChIInChI=1S/C10H19NO/c1-7-6-8-4-5-9(11(8)2)10(7)12-3/h7-10H,4-6H2,1-3H3
InChIKeyUKTKIPUQRIONMY-UHFFFAOYSA-N
XLogP1.50
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane?
The IUPAC name of 2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane (CID 58479350) is 2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane is COC1C(C)CC2CCC1N2C.
What is the InChIKey of 2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane?
The InChIKey is UKTKIPUQRIONMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-7-6-8-4-5-9(11(8)2)10(7)12-3/h7-10H,4-6H2,1-3H3.
What are the key properties of 2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane?
2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane has a molecular weight of 169.27 g/mol, XLogP of 1.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3,8-dimethyl-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 58479350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).