CAS 13258-63-4|4-pyridine ethaneamine|2-(pyridin-4-yl)ethan-1-amine|2-Pyridin-4-yl-ethylamine|4-(2-Aminoethyl)pyridine|2-(Pyridin-4-yl)ethylamine|2-(pyridin-4-yl)ethanamine|(2-pyridin-4-ylethyl)amin...

General Information

Structure

Molecular Formula

C₇H₁₀N₂

Molecular Mass

122.1677

Exact Mass

122.08439833

Charge

InChI

InChI=1S/C7H10N2/c8-4-1-7-2-5-9-6-3-7/h2-3,5-6H,1,4,8H2

InChIKey

IDLHTECVNDEOIY-UHFFFAOYSA-N

Canonic Smiles

NCCc1ccncc1

Isomeric Smiles

n1ccc(CCN)cc1

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

-3.1017582

LogD (pH = 7.4)

-2.0964503

Log P

0.17000303

Molar Refractivity

37.1295

Polarizability

14.572318

Polar Surface Area

38.91

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

IUPAC Traditional name

4-pyridine ethaneamine

Synonyms

2-Pyridin-4-yl-ethylamine4-(2-Aminoethyl)pyridine2-(Pyridin-4-yl)ethylamine2-(pyridin-4-yl)ethanamine(2-pyridin-4-ylethyl)amine4-(2-Aminoethyl)pyridine4-(2-氨基乙基)吡啶2-(pyridin-4-yl)ethan-1-amine2-(4-Pyridyl)ethylamine4-Pyridineethanamine4-(2-氨乙基)吡啶4-Pyridineethylamine

IUPAC name

2-(pyridin-4-yl)ethan-1-amine

Names and Identifiers

Registration numbers

MDL Number

CAS Number

PubChem SID

PubChem CID