Pyrimidine-4,6-diamine

C₄H₆N₄CAS 2434-56-2110.12 g/mol

Open in Covalent MOL file

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

Identifiers

CAS number

2434-56-2

SMILES

C1=C(N=CN=C1N)N

InChIKey

MISVBCMQSJUHMH-UHFFFAOYSA-N

InChI

InChI=1S/C4H6N4/c5-3-1-4(6)8-2-7-3/h1-2H,(H4,5,6,7,8)

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

Names and synonyms

1 names

4,6-Diaminopyrimidine

Work with Pyrimidine-4,6-diamine

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

6-Amino-4(3H)-pyrimidinone1193-22-262 % similar 6-Methoxy-4-pyrimidinamine696-45-754 % similar 2-Amino-4,5-dichloropyridine188577-68-642 % similar Isoquinolin-3-amine25475-67-640 % similar 5-Iodo-4-methyl-pyridin-2-ylamine356561-08-537 % similar 2-Amino-4-methoxypyridine10201-73-736 % similar (2-Aminopyridin-4-yl)methanol105250-17-736 % similar 2-Amino-4-(trifluoromethyl)pyridine106447-97-636 % 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 2,5-Diaminopyrimidine22715-27-1 2,6-Pyrazinediamine(9ci)41536-80-5

Elsewhere

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