2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine

C10H18N2 — CID 70083307

IUPAC2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine
SMILESNCCC1C2CC3CC1N(C3)C2
InChIInChI=1S/C10H18N2/c11-2-1-9-8-3-7-4-10(9)12(5-7)6-8/h7-10H,1-6,11H2
InChIKeyLYWDKEGIDKBEIG-UHFFFAOYSA-N
MW166.27 g/mol
LogP0.68
Rot. Bonds2

About 2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine

2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine (PubChem CID 70083307) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine.

Molecular Properties

Compound Name2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine
PubChem CID70083307
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine
SMILESNCCC1C2CC3CC1N(C3)C2
InChIInChI=1S/C10H18N2/c11-2-1-9-8-3-7-4-10(9)12(5-7)6-8/h7-10H,1-6,11H2
InChIKeyLYWDKEGIDKBEIG-UHFFFAOYSA-N
XLogP0.68
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)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 2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine?
The IUPAC name of 2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine (CID 70083307) is 2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine.
What is the SMILES notation for 2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine?
The canonical SMILES for 2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine is NCCC1C2CC3CC1N(C3)C2.
What is the InChIKey of 2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine?
The InChIKey is LYWDKEGIDKBEIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c11-2-1-9-8-3-7-4-10(9)12(5-7)6-8/h7-10H,1-6,11H2.
What are the key properties of 2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine?
2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine has a molecular weight of 166.27 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-azatricyclo[3.3.1.03,7]nonan-6-yl)ethanamine is sourced from PubChem (CID 70083307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).