5,6,7,8-Tetrahydroimidazo(1,2-a)pyrazine

C₆H₉N₃CAS 91476-80-1123.16 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₆H₉N₃
Molar mass: 123.16 g/mol
Exact mass: 123.0796 Da
logP: -0.01Crippen estimate
Polar surface area: 29.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

Danger

H301 Toxic if swallowed33.3% of notifiers
H302 Harmful if swallowed66.7% of notifiers
H312 Harmful in contact with skin33.3% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled66.7% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P316, 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

91476-80-1

SMILES

C1CN2C=CN=C2CN1

InChIKey

SWBUHQQTIPEPMK-UHFFFAOYSA-N

InChI

InChI=1S/C6H9N3/c1-3-9-4-2-8-6(9)5-7-1/h2,4,7H,1,3,5H2

Weigh it out

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

Names and synonyms

1 names

5,6,7,8-Tetrahydroimidazo[1,2-A]pyrazine

Work with 5,6,7,8-Tetrahydroimidazo(1,2-a)pyrazine

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 5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxylate91476-82-335 % similar 1-Propyl-2-methylimidazole33214-18-533 % similar 3-(Trifluoromethyl)-5,6,7,8-tetrahydro-(1,2,4)triazolo(4,3-a)pyrazine486460-21-333 % similar (1-Benzyl-1H-imidazol-2-yl)methanol5376-10-333 % similar 2-Methyl-1H-imidazole-1-ethanol1615-15-232 % similar 1-Butyl-2-methyl-1H-imidazole13435-22-832 % similar N-Ethyl-2-methylimidazole21202-52-831 % similar 3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine hydrochloride762240-92-631 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Idpn (chemical)111-94-4 3,6-Dimethylpyrazin-2-amine13134-38-8 2-(Aminomethyl)-5-methylpyrazine132664-85-8 3-Cyclopropyl-1H-pyrazol-5-amine175137-46-9 2,6-Dimethyl-4-pyrimidinamine461-98-3 4-Methylpyridine-2,3-diamine53929-59-2 5H,6H,7H,8H-Imidazo[1,2-a]pyrimidine67139-22-4 4,5,6,7-Tetrahydro-1H-imidazo[4,5-C]pyridine6882-74-2

Elsewhere

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