CAS 50392-78-4|CAS 174132-32-2|1-(pyridin-4-yl)ethanamine|1-(pyridin-4-yl)ethan-1-amine|1-Pyridin-4-yl-ethylamine|4-(1-Aminoethyl)pyridine|1-(Pyridin-4-yl)ethylamine|1-吡啶-乙基胺|1-(4-吡啶基)乙胺|4...

General Information

Structure

Molecular Formula

C₇H₁₀N₂

Molecular Mass

122.1677

Exact Mass

122.08439833

Charge

InChI

InChI=1S/C7H10N2/c1-6(8)7-2-4-9-5-3-7/h2-6H,8H2,1H3

InChIKey

HIZMJYQEHFJWQY-UHFFFAOYSA-N

Canonic Smiles

CC(c1ccncc1)N

Isomeric Smiles

n1ccc(C(N)C)cc1

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

-2.6926537

LogD (pH = 7.4)

-1.7596408

Log P

0.29791686

Molar Refractivity

36.7933

Polarizability

14.649602

Polar Surface Area

38.91

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

IUPAC Traditional name

1-(pyridin-4-yl)ethanamine

IUPAC name

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

Synonyms

1-Pyridin-4-yl-ethylamine4-(1-Aminoethyl)pyridine1-(Pyridin-4-yl)ethylamine1-(4-吡啶基)乙胺1-Pyridin-4-yl-ethylamine4-(1-Aminoethyl)pyridine1-(4-Pyridyl)ethylamine1-吡啶-乙基胺4-(1-氨乙基)吡啶1-pyridin-4-ylethanaminealpha-Methyl-4-pyridinemethylamine1-(4-吡啶基)-乙基胺1-(4-Pyridyl)ethylamine(1-pyridin-4-ylethyl)amine

Names and Identifiers

Registration numbers

CAS Number

50392-78-4174132-32-2

MDL Number

MFCD02245004

PubChem SID

160976838

PubChem CID

247998

Registration numbers

Properties