3-Aminopyridine-2-thiol

C₅H₆N₂SCAS 38240-21-0126.18 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₆N₂S
Molar mass: 126.18 g/mol
Exact mass: 126.0252 Da
logP: 1.33Crippen estimate
Polar surface area: 41.8 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

38240-21-0

SMILES

C1=CNC(=S)C(=C1)N

InChIKey

ADMMJKIQWOJMSK-UHFFFAOYSA-N

InChI

InChI=1S/C5H6N2S/c6-4-2-1-3-7-5(4)8/h1-3H,6H2,(H,7,8)

Weigh it out

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

Names and synonyms

1 names

2(1H)-Pyridinethione,3-amino-(9ci)

Work with 3-Aminopyridine-2-thiol

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

3-Amino-2-pyridinol59315-44-556 % similar 3-Bromopyridine-2-thiol65938-86-552 % similar 3-(Trifluoromethyl)pyridine-2-thiol104040-74-645 % similar O-Phenylenediamine95-54-539 % similar 7-Aminoindole5192-04-139 % similar 4-Aminoindole5192-23-439 % similar 1,5-Diaminonaphthalene2243-62-135 % similar Pyrrole-2-carboxaldehyde1003-29-833 % similar

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

Same formula

2-(Methylthio)pyrazine21948-70-9 Pyrazinemethanethiol59021-02-2

Elsewhere

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