Tetrahydrothiopyran-4-ylamine

C5H11NSCAS 21926-00-1117.21 g/mol

Open in Covalent MOL file
SH2N
Primary amineSulfide

Properties

Molecular formula
C5H11NS
Molar mass
117.21 g/mol
Exact mass
117.0612 Da
logP
0.84Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from the 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
21926-00-1
SMILES
C1CSCCC1N
InChIKey
RPIXOLUIHUFDOY-UHFFFAOYSA-N
InChI
InChI=1S/C5H11NS/c6-5-1-3-7-4-2-5/h5H,1-4,6H2

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Names and synonyms

1 names
  • Tetrahydro-2H-thiopyran-4-amine

Work with Tetrahydrothiopyran-4-ylamine

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

trans-1,4-Diaminocyclohexane2615-25-053 % similar 1,4-Diaminocyclohexane3114-70-353 % similar Cyclopropylamine765-30-053 % similar Cyclopentylamine1003-03-847 % similar Cyclobutylamine2516-34-947 % similar Cyclohexylammonium bromide26227-54-345 % similar Cyclohexylamine108-91-844 % similar Cyclododecanamine1502-03-044 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,2-Dimethylthiazolidine19351-18-9 2,2-Dimethylpropanethioamide630-22-8

Elsewhere

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