5-Acetyl-2-amino-4-methylthiazole

C₆H₈N₂OSCAS 30748-47-1156.20 g/mol

Open in Covalent MOL file

Ketone Primary amine

Properties

Molecular formula: C₆H₈N₂OS
Molar mass: 156.20 g/mol
Exact mass: 156.0357 Da
logP: 1.24Crippen estimate
Polar surface area: 56.0 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed10.9% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.8% of notifiers

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

30748-47-1

SMILES

CC1=C(SC(=N1)N)C(=O)C

InChIKey

PKUKCASRNJIQNU-UHFFFAOYSA-N

InChI

InChI=1S/C6H8N2OS/c1-3-5(4(2)9)10-6(7)8-3/h1-2H3,(H2,7,8)

Weigh it out

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

Names and synonyms

1 names

2-Amino-4-methyl-5-acetylthiazole

Work with 5-Acetyl-2-amino-4-methylthiazole

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

Similar compounds

Methyl 2-amino-4-methyl-1,3-thiazole-5-carboxylate3829-80-963 % similar 5-Acetyl-2,4-dimethylthiazole38205-60-663 % similar Ethyl 2-amino-4-methylthiazole-5-carboxylate7210-76-658 % similar 4,5-Dimethyl-1,3-thiazol-2-amine2289-75-047 % similar 2-Amino-4,5-dimethylthiazole hydrochloride71574-33-943 % similar 1-(2-Amino-4-methylpyrimidin-5-yl)ethan-1-one66373-25-940 % similar 2-Acetyl-3-aminothiophene31968-33-938 % similar 2-Amino-4,5,6,7-tetrahydro-1,3-benzothiazol-7-one17583-10-738 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Thiopheneacetic acid hydrazide175276-94-5 2-Amino-4-methylthiophene-3-carboxamide4651-97-2 [(Furan-2-yl)methyl]thiourea56541-07-2 2-Acetamido-4-methylthiazole7336-51-8

Elsewhere

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