2-Amino-3,5-dimethylpyrazine

C₆H₉N₃CAS 91678-81-8123.16 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₆H₉N₃
Molar mass: 123.16 g/mol
Exact mass: 123.0796 Da
logP: 0.68Crippen estimate
Polar surface area: 51.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin50% of notifiers
H315 Causes skin irritation50% of notifiers
H319 Causes serious eye irritation50% of notifiers
H332 Harmful if inhaled50% of notifiers
H335 May cause respiratory irritation50% of notifiers

Aggregated from 2 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

91678-81-8

SMILES

CC1=CN=C(C(=N1)C)N

InChIKey

GZZRWBRYYZGTNW-UHFFFAOYSA-N

InChI

InChI=1S/C6H9N3/c1-4-3-8-6(7)5(2)9-4/h3H,1-2H3,(H2,7,8)

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Names and synonyms

1 names

3,5-Dimethylpyrazin-2-amine

Work with 2-Amino-3,5-dimethylpyrazine

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

2,3,5-Trimethylpyrazine14667-55-160 % similar 2-Chloro-3,5-dimethylpyrazine38557-72-152 % similar 2-Ethyl-3,5-dimethylpyrazine13925-07-048 % similar 3-Methyl-2-pyrazinamine19838-08-548 % similar 3-Chloro-2,5-dimethylpyrazine95-89-647 % similar 2-Acetyl-3,5-dimethylpyrazine54300-08-244 % similar 2,6-Dimethyl-3-pyridylamine3430-33-943 % similar 2,5-Dimethylpyrazine123-32-042 % 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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