8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane

C10H19NO — CID 58468802

IUPAC8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane
SMILESCC(C)C1OCC2CCC1N2C
InChIInChI=1S/C10H19NO/c1-7(2)10-9-5-4-8(6-12-10)11(9)3/h7-10H,4-6H2,1-3H3
InChIKeyGYIGQQGYLFVRKC-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.50
Rot. Bonds1

About 8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane

8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane (PubChem CID 58468802) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane
PubChem CID58468802
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane
SMILESCC(C)C1OCC2CCC1N2C
InChIInChI=1S/C10H19NO/c1-7(2)10-9-5-4-8(6-12-10)11(9)3/h7-10H,4-6H2,1-3H3
InChIKeyGYIGQQGYLFVRKC-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 8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane?
The IUPAC name of 8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane (CID 58468802) is 8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane is CC(C)C1OCC2CCC1N2C.
What is the InChIKey of 8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane?
The InChIKey is GYIGQQGYLFVRKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-7(2)10-9-5-4-8(6-12-10)11(9)3/h7-10H,4-6H2,1-3H3.
What are the key properties of 8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane?
8-methyl-2-propan-2-yl-3-oxa-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 8-methyl-2-propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 58468802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).