2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine

C12H24N2 — CID 82241138

IUPAC2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine
SMILESCC(C)N1C2CCC1CC(CCN)C2
InChIInChI=1S/C12H24N2/c1-9(2)14-11-3-4-12(14)8-10(7-11)5-6-13/h9-12H,3-8,13H2,1-2H3
InChIKeyPOQAZIACVXYNDD-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.99
Rot. Bonds3

About 2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine

2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine (PubChem CID 82241138) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine
PubChem CID82241138
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine
SMILESCC(C)N1C2CCC1CC(CCN)C2
InChIInChI=1S/C12H24N2/c1-9(2)14-11-3-4-12(14)8-10(7-11)5-6-13/h9-12H,3-8,13H2,1-2H3
InChIKeyPOQAZIACVXYNDD-UHFFFAOYSA-N
XLogP1.99
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine?
The IUPAC name of 2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine (CID 82241138) is 2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine.
What is the SMILES notation for 2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine?
The canonical SMILES for 2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine is CC(C)N1C2CCC1CC(CCN)C2.
What is the InChIKey of 2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine?
The InChIKey is POQAZIACVXYNDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-9(2)14-11-3-4-12(14)8-10(7-11)5-6-13/h9-12H,3-8,13H2,1-2H3.
What are the key properties of 2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine?
2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine has a molecular weight of 196.34 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine is sourced from PubChem (CID 82241138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).