2-(3-pyridin-2-ylphenyl)ethanamine

C13H14N2 — CID 39226476

IUPAC2-(3-pyridin-2-ylphenyl)ethanamine
SMILESNCCc1cccc(-c2ccccn2)c1
InChIInChI=1S/C13H14N2/c14-8-7-11-4-3-5-12(10-11)13-6-1-2-9-15-13/h1-6,9-10H,7-8,14H2
InChIKeyQTRCRRCTJKGYGG-UHFFFAOYSA-N
MW198.27 g/mol
LogP2.25
Rot. Bonds3

About 2-(3-pyridin-2-ylphenyl)ethanamine

2-(3-pyridin-2-ylphenyl)ethanamine (PubChem CID 39226476) has the molecular formula C13H14N2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2-(3-pyridin-2-ylphenyl)ethanamine.

Molecular Properties

Compound Name2-(3-pyridin-2-ylphenyl)ethanamine
PubChem CID39226476
Molecular FormulaC13H14N2
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC Name2-(3-pyridin-2-ylphenyl)ethanamine
SMILESNCCc1cccc(-c2ccccn2)c1
InChIInChI=1S/C13H14N2/c14-8-7-11-4-3-5-12(10-11)13-6-1-2-9-15-13/h1-6,9-10H,7-8,14H2
InChIKeyQTRCRRCTJKGYGG-UHFFFAOYSA-N
XLogP2.25
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-pyridin-2-ylphenyl)ethanamine?
The IUPAC name of 2-(3-pyridin-2-ylphenyl)ethanamine (CID 39226476) is 2-(3-pyridin-2-ylphenyl)ethanamine.
What is the SMILES notation for 2-(3-pyridin-2-ylphenyl)ethanamine?
The canonical SMILES for 2-(3-pyridin-2-ylphenyl)ethanamine is NCCc1cccc(-c2ccccn2)c1.
What is the InChIKey of 2-(3-pyridin-2-ylphenyl)ethanamine?
The InChIKey is QTRCRRCTJKGYGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2/c14-8-7-11-4-3-5-12(10-11)13-6-1-2-9-15-13/h1-6,9-10H,7-8,14H2.
What are the key properties of 2-(3-pyridin-2-ylphenyl)ethanamine?
2-(3-pyridin-2-ylphenyl)ethanamine has a molecular weight of 198.27 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-pyridin-2-ylphenyl)ethanamine is sourced from PubChem (CID 39226476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).