5-Cyclopropyl-1,3,4-thiadiazol-2-amine

C₅H₇N₃SCAS 57235-50-4141.19 g/mol

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Properties

Molecular formula: C₅H₇N₃S
Molar mass: 141.19 g/mol
Exact mass: 141.0361 Da
logP: 1.00Crippen estimate
Polar surface area: 51.8 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 1

Hazards

Danger

H301 Toxic if swallowed100% of notifiers

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P316, P321, P330, P405, P501

Identifiers

CAS number

57235-50-4

SMILES

C1CC1C2=NN=C(S2)N

InChIKey

AVLUMBXGKFNNAS-UHFFFAOYSA-N

InChI

InChI=1S/C5H7N3S/c6-5-8-7-4(9-5)3-1-2-3/h3H,1-2H2,(H2,6,8)

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Names and synonyms

1 names

2-Amino-5-cyclopropyl-1,3,4-thiadiazole

Work with 5-Cyclopropyl-1,3,4-thiadiazol-2-amine

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

2-Amino-5-bromo-[1,3,4]thiadiazole37566-39-539 % similar 5-Propyl-1,3,4-thiadiazol-2-amine39223-04-638 % similar Ethyl 5-amino-1,3,4-thiadiazole-2-carboxylate64837-53-231 % similar 2-Amino-5-(4-bromophenyl)-1,3,4-thiadiazole13178-12-631 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-(Methylthio)pyrimidin-4-amine2183-66-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook