N-Methyl-2-(1-methylethyl)-4-thiazolemethanamine

C₈H₁₄N₂SCAS 154212-60-9170.27 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₈H₁₄N₂S
Molar mass: 170.27 g/mol
Exact mass: 170.0878 Da
logP: 1.99Crippen estimate
Polar surface area: 24.9 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 3

Hazards

Danger

H302 Harmful if swallowedAcute toxicity, oral
H312 Harmful in contact with skinAcute toxicity, dermal
H315 Causes skin irritationSkin corrosion/irritation
H318 Causes serious eye damageSerious eye damage/eye irritation
H411 Toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 612-192-00-9), via PubChem.

Precautionary statements

P264, P264+P265, P270, P273, P280, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P332+P317, P362+P364, P391, P501

Identifiers

CAS number

154212-60-9

SMILES

CNCc1csc(C(C)C)n1

InChIKey

HWSFABGWAXURNG-UHFFFAOYSA-N

InChI

InChI=1S/C8H14N2S/c1-6(2)8-10-7(4-9-3)5-11-8/h5-6,9H,4H2,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names

4-Thiazolemethanamine, N-methyl-2-(1-methylethyl)-
2-Isopropyl-4-(N-methylaminomethyl)thiazole
N-Methyl-2-isopropyl-4-thiazolemethylamine
2-Isopropyl-4-[(methylamino)methyl]thiazole
1-(2-Isopropylthiazol-4-yl)-N-methylmethanamine
2-Isopropyl-4-(N-methyl)amino-methyl thiazole

Work with N-Methyl-2-(1-methylethyl)-4-thiazolemethanamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

1-(2-Isopropyl-1,3-thiazol-4-yl)-N-methylmethanamine dihydrochloride1185167-55-8Salt 2-Isopropyl-4-((N-methylamino)methyl)thiazole hydrochloride908591-25-3Salt

Similar compounds

5-Chloromethyl-2-isopropyl-thiazole40516-57-261 % similar 2-Isopropyl-4-methylthiazole15679-13-748 % similar Ureidovaline154212-61-036 % similar N-Methyl-4-pyridinemethanamine6971-44-431 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook