2-indolizin-3-ylethanamine

C10H12N2 — CID 96634104

IUPAC2-indolizin-3-ylethanamine
SMILESNCCc1ccc2ccccn12
InChIInChI=1S/C10H12N2/c11-7-6-10-5-4-9-3-1-2-8-12(9)10/h1-5,8H,6-7,11H2
InChIKeyNVFWHECAYLZTGK-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.44
Rot. Bonds2

About 2-indolizin-3-ylethanamine

2-indolizin-3-ylethanamine (PubChem CID 96634104) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 2-indolizin-3-ylethanamine.

Molecular Properties

Compound Name2-indolizin-3-ylethanamine
PubChem CID96634104
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name2-indolizin-3-ylethanamine
SMILESNCCc1ccc2ccccn12
InChIInChI=1S/C10H12N2/c11-7-6-10-5-4-9-3-1-2-8-12(9)10/h1-5,8H,6-7,11H2
InChIKeyNVFWHECAYLZTGK-UHFFFAOYSA-N
XLogP1.44
TPSA30.43 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-indolizin-3-ylethanamine 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-indolizin-3-ylethanamine?
The IUPAC name of 2-indolizin-3-ylethanamine (CID 96634104) is 2-indolizin-3-ylethanamine.
What is the SMILES notation for 2-indolizin-3-ylethanamine?
The canonical SMILES for 2-indolizin-3-ylethanamine is NCCc1ccc2ccccn12.
What is the InChIKey of 2-indolizin-3-ylethanamine?
The InChIKey is NVFWHECAYLZTGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c11-7-6-10-5-4-9-3-1-2-8-12(9)10/h1-5,8H,6-7,11H2.
What are the key properties of 2-indolizin-3-ylethanamine?
2-indolizin-3-ylethanamine has a molecular weight of 160.22 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-indolizin-3-ylethanamine is sourced from PubChem (CID 96634104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).