2,6-Dimethyl-4-pyrimidinamine

C₆H₉N₃CAS 461-98-3123.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₉N₃
Molar mass: 123.16 g/mol
Exact mass: 123.0796 Da
Melting point: 183 °C
logP: 0.51Crippen estimate
Polar surface area: 52.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed14.3% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation85.7% of notifiers

Aggregated from 7 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

461-98-3

SMILES

Cc1cc(=N)[nH]c(C)n1

InChIKey

BJJDXAFKCKSLTE-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

14 names · show all

4-Pyrimidinamine, 2,6-dimethyl-
Pyrimidine, 4-amino-2,6-dimethyl-
4-Amino-2,6-dimethylpyrimidine
6-Amino-2,4-dimethylpyrimidine
Cyanmethine
Cyanomethine
Kyanmethin
Kyanmethine
2,4-Dimethyl-6-aminopyrimidine
2,6-Dimethyl-4-pyrimidinylamine
2,6-Dimethyl-4-aminopyrimidine
2,6-Dimethylpyrimidin-4-amine
NSC 21637
2,6-Dimethylpyrimidine-4-amine

Reactions

4-AMINO-2,6-DIMETHYLPYRIMIDINE (Pyrimidine, 4-amino-2,6-dimethyl-)product

Work with 2,6-Dimethyl-4-pyrimidinamine

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-Chloro-6-methyl-4-pyrimidinamine14394-60-663 % similar 4-Amino-6-methylpyrimidine3435-28-745 % similar 2,4,6-Trimethylpyridine108-75-844 % similar 2-Amino-5,7-dimethyl-1,8-naphthyridine39565-07-643 % similar 3-Amino-6-methylpyridazine18591-82-740 % similar Acetoguanamine542-02-940 % similar 2,6-Dichloro-4-pyrimidinamine10132-07-739 % similar 2,5,6-Trimethylbenzimidazole3363-56-238 % 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 2-Amino-4,6-dimethylpyrimidine767-15-7

Elsewhere

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