2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine

C13H13ClN2 — CID 83713592

IUPAC2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine
SMILESNCCc1cccc(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C13H13ClN2/c14-11-6-4-10(5-7-11)13-3-1-2-12(16-13)8-9-15/h1-7H,8-9,15H2
InChIKeyCEDBERBZOIGOSE-UHFFFAOYSA-N
MW232.71 g/mol
LogP2.90
Rot. Bonds3

About 2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine

2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine (PubChem CID 83713592) has the molecular formula C13H13ClN2 and a molecular weight of 232.71 g/mol. Its IUPAC name is 2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine.

Molecular Properties

Compound Name2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine
PubChem CID83713592
Molecular FormulaC13H13ClN2
Molecular Weight232.71 g/mol
Exact Mass232.08
IUPAC Name2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine
SMILESNCCc1cccc(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C13H13ClN2/c14-11-6-4-10(5-7-11)13-3-1-2-12(16-13)8-9-15/h1-7H,8-9,15H2
InChIKeyCEDBERBZOIGOSE-UHFFFAOYSA-N
XLogP2.90
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.71
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[6-(4-chlorophenyl)-2-pyridinyl]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-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine?
The IUPAC name of 2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine (CID 83713592) is 2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine.
What is the SMILES notation for 2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine?
The canonical SMILES for 2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine is NCCc1cccc(-c2ccc(Cl)cc2)n1.
What is the InChIKey of 2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine?
The InChIKey is CEDBERBZOIGOSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN2/c14-11-6-4-10(5-7-11)13-3-1-2-12(16-13)8-9-15/h1-7H,8-9,15H2.
What are the key properties of 2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine?
2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine has a molecular weight of 232.71 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine is sourced from PubChem (CID 83713592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).