N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine

C10H17N — CID 43225176

IUPACN-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine
SMILESCCNCC1CC2C=CC1C2
InChIInChI=1S/C10H17N/c1-2-11-7-10-6-8-3-4-9(10)5-8/h3-4,8-11H,2,5-7H2,1H3
InChIKeyVMYVYQRZCLDPNG-UHFFFAOYSA-N
MW151.25 g/mol
LogP1.81
Rot. Bonds3

About N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine

N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine (PubChem CID 43225176) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine
PubChem CID43225176
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC NameN-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine
SMILESCCNCC1CC2C=CC1C2
InChIInChI=1S/C10H17N/c1-2-11-7-10-6-8-3-4-9(10)5-8/h3-4,8-11H,2,5-7H2,1H3
InChIKeyVMYVYQRZCLDPNG-UHFFFAOYSA-N
XLogP1.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine?
The IUPAC name of N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine (CID 43225176) is N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine.
What is the SMILES notation for N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine?
The canonical SMILES for N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine is CCNCC1CC2C=CC1C2.
What is the InChIKey of N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine?
The InChIKey is VMYVYQRZCLDPNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-2-11-7-10-6-8-3-4-9(10)5-8/h3-4,8-11H,2,5-7H2,1H3.
What are the key properties of N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine?
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine has a molecular weight of 151.25 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]hept-5-enylmethyl)ethanamine is sourced from PubChem (CID 43225176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).