2,5-Diaminopyrimidine

C₄H₆N₄CAS 22715-27-1110.12 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₄H₆N₄
Molar mass: 110.12 g/mol
Exact mass: 110.0592 Da
logP: -0.36Crippen estimate
Polar surface area: 77.8 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

22715-27-1

SMILES

C1=C(C=NC(=N1)N)N

InChIKey

DNACGYGXUFTEHO-UHFFFAOYSA-N

InChI

InChI=1S/C4H6N4/c5-3-1-7-4(6)8-2-3/h1-2H,5H2,(H2,6,7,8)

Weigh it out

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

Names and synonyms

1 names

Pyrimidine-2,5-diamine

Work with 2,5-Diaminopyrimidine

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-5-pyrimidinamine56621-90-055 % similar 2-Amino-5-hydroxypyrimidine143489-45-652 % similar 2-Methylpyrimidin-5-amine39889-94-652 % similar 2-Aminopyrimidine-5-carbaldehyde120747-84-446 % similar 2-Amino-5-methoxypyrimidine13418-77-446 % similar 2-Methoxypyrimidin-5-amine56621-89-746 % similar 5-Amino-2-pyrimidinecarbonitrile56621-93-346 % similar 6-(5-Aminopyridin-2-yl)pyridin-3-amine52382-48-645 % similar

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

Same formula

4,5-Diaminopyrimidine13754-19-3 2,4-Diaminopyrimidine156-81-0 Pyrimidine-4,6-diamine2434-56-2 2,6-Pyrazinediamine(9ci)41536-80-5 Pyrazin-2-yl-hydrazine54608-52-5

Elsewhere

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