(2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine

C10H17N — CID 18622242

IUPAC(2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine
SMILESCCC1(CN)CC2C=CC1C2
InChIInChI=1S/C10H17N/c1-2-10(7-11)6-8-3-4-9(10)5-8/h3-4,8-9H,2,5-7,11H2,1H3
InChIKeyQAQWETQYRWAAKX-UHFFFAOYSA-N
MW151.25 g/mol
LogP1.94
Rot. Bonds2

About (2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine

(2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine (PubChem CID 18622242) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine.

Molecular Properties

Compound Name(2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine
PubChem CID18622242
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine
SMILESCCC1(CN)CC2C=CC1C2
InChIInChI=1S/C10H17N/c1-2-10(7-11)6-8-3-4-9(10)5-8/h3-4,8-9H,2,5-7,11H2,1H3
InChIKeyQAQWETQYRWAAKX-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'}

Analyze (2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine 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 (2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine?
The IUPAC name of (2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine (CID 18622242) is (2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine.
What is the SMILES notation for (2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine?
The canonical SMILES for (2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine is CCC1(CN)CC2C=CC1C2.
What is the InChIKey of (2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine?
The InChIKey is QAQWETQYRWAAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-2-10(7-11)6-8-3-4-9(10)5-8/h3-4,8-9H,2,5-7,11H2,1H3.
What are the key properties of (2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine?
(2-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine 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-ethyl-2-bicyclo[2.2.1]hept-5-enyl)methanamine is sourced from PubChem (CID 18622242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).