chempirical

Ethyl 2-aminothiazole-5-carboxylate

C6H8N2O2SCAS 32955-21-8172.20 g/mol

Open in Covalent MOL file
OONSNH2
EsterPrimary amine

Properties

Molecular formula
C6H8N2O2S
Molar mass
172.20 g/mol
Exact mass
172.0306 Da
logP
0.90Crippen estimate
Polar surface area
65.2 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
2

Identifiers

CAS number
32955-21-8
SMILES
CCOC(=O)C1=CN=C(S1)N
InChIKey
VNZXERIGKZNEKB-UHFFFAOYSA-N
InChI
InChI=1S/C6H8N2O2S/c1-2-10-5(9)4-3-8-6(7)11-4/h3H,2H2,1H3,(H2,7,8)

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Names and synonyms

1 names
  • 2-Amino-thiazole-5-carboxylic acid ethyl ester

Work with Ethyl 2-aminothiazole-5-carboxylate

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

Ethyl 2-bromothiazole-5-carboxylate41731-83-364 % similar Ethyl 2-(trifluoromethyl)thiazole-5-carboxylate131748-96-460 % similar Ethyl thiazole-5-carboxylate32955-22-954 % similar 5-Aminopyrazine-2-carboxylic acid ethyl ester54013-06-854 % similar Ethyl 6-aminonicotinate39658-41-852 % similar Ethyl 2-amino-1,3-oxazole-5-carboxylate113853-16-049 % similar 2-Amino-3-methyl-3H-imidazole-4-carboxylic acid ethyl ester177760-04-248 % similar Ethyl 2-thiophenecarboxylate2810-04-048 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

L-4-Thiazolylalanine119433-80-6 D-4-Thiazolylalanine131896-42-9 6-(Methoxymethyl)-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one175205-07-9 Ethyl 4-methyl-1,2,3-thiadiazole-5-carboxylate18212-20-9 2-Aminobenzenesulfonamide3306-62-5 Methyl 2-amino-4-methyl-1,3-thiazole-5-carboxylate3829-80-9 Ethyl 2-amino-4-thiazolecarboxylate5398-36-7 Sulfanilamide63-74-1

Elsewhere

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