2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine

C10H17N — CID 141058052

IUPAC2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine
SMILESNCCC1C2C=CCC1CC2
InChIInChI=1S/C10H17N/c11-7-6-10-8-2-1-3-9(10)5-4-8/h1-2,8-10H,3-7,11H2
InChIKeyIKIHXQZSNSGNOY-UHFFFAOYSA-N
MW151.25 g/mol
LogP1.94
Rot. Bonds2

About 2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine

2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine (PubChem CID 141058052) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine.

Molecular Properties

Compound Name2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine
PubChem CID141058052
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine
SMILESNCCC1C2C=CCC1CC2
InChIInChI=1S/C10H17N/c11-7-6-10-8-2-1-3-9(10)5-4-8/h1-2,8-10H,3-7,11H2
InChIKeyIKIHXQZSNSGNOY-UHFFFAOYSA-N
XLogP1.94
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine?
The IUPAC name of 2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine (CID 141058052) is 2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine.
What is the SMILES notation for 2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine?
The canonical SMILES for 2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine is NCCC1C2C=CCC1CC2.
What is the InChIKey of 2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine?
The InChIKey is IKIHXQZSNSGNOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c11-7-6-10-8-2-1-3-9(10)5-4-8/h1-2,8-10H,3-7,11H2.
What are the key properties of 2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine?
2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine has a molecular weight of 151.25 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-bicyclo[3.2.1]oct-2-enyl)ethanamine is sourced from PubChem (CID 141058052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).