6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane

C10H19NO — CID 142605107

IUPAC6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane
SMILESCC1(C)C2CNCC(O2)C1(C)C
InChIInChI=1S/C10H19NO/c1-9(2)7-5-11-6-8(12-7)10(9,3)4/h7-8,11H,5-6H2,1-4H3
InChIKeyGRGKGBKEEWYCAW-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.41
Rot. Bonds

About 6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane

6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane (PubChem CID 142605107) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane
PubChem CID142605107
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane
SMILESCC1(C)C2CNCC(O2)C1(C)C
InChIInChI=1S/C10H19NO/c1-9(2)7-5-11-6-8(12-7)10(9,3)4/h7-8,11H,5-6H2,1-4H3
InChIKeyGRGKGBKEEWYCAW-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane?
The IUPAC name of 6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane (CID 142605107) is 6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane.
What is the SMILES notation for 6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane?
The canonical SMILES for 6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane is CC1(C)C2CNCC(O2)C1(C)C.
What is the InChIKey of 6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane?
The InChIKey is GRGKGBKEEWYCAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-9(2)7-5-11-6-8(12-7)10(9,3)4/h7-8,11H,5-6H2,1-4H3.
What are the key properties of 6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane?
6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane has a molecular weight of 169.27 g/mol, XLogP of 1.41, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6,7,7-tetramethyl-8-oxa-3-azabicyclo[3.2.1]octane is sourced from PubChem (CID 142605107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).