CAS 144163-81-5|methyl[(2-methyl-1,3-thiazol-4-yl)methyl]amine|N-Methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]amine|methyl[(2-methyl-1,3-thiazol-4-yl)methyl]amine|2-Methyl-4-[(methylamino)methyl]-1,3...

General Information

Structure

Molecular Formula

C₆H₁₀N₂S

Molecular Mass

142.222

Exact Mass

142.05646933

Charge

InChI

InChI=1S/C6H10N2S/c1-5-8-6(3-7-2)4-9-5/h4,7H,3H2,1-2H3

InChIKey

GJHOBSIOQKGKSG-UHFFFAOYSA-N

Canonic Smiles

CNCc1csc(n1)C

Isomeric Smiles

n1c(scc1CNC)C

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

-2.1180558

LogD (pH = 7.4)

-0.3839794

Log P

0.39492404

Molar Refractivity

38.4329

Polarizability

15.071386

Polar Surface Area

24.92

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Commercial Catalog

Academic Data

Data Source

Names and Identifiers

IUPAC name

methyl[(2-methyl-1,3-thiazol-4-yl)methyl]amine

Synonyms

N-Methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]amine2-Methyl-4-[(methylamino)methyl]-1,3-thiazole 97%N,2-dimethyl-(1,3-thiazol-4-yl)methylamineN-methyl-1-(2-methylthiazol-4-yl)methanaminemethyl[(2-methyl-1,3-thiazol-4-yl)methyl]amineN-methyl-1-(2-methyl-1,3-thiazol-4-yl)methanamine

IUPAC Traditional name

methyl[(2-methyl-1,3-thiazol-4-yl)methyl]amine

Names and Identifiers

Registration numbers

CAS Number

MDL Number

PubChem CID

PubChem SID