chempirical

3,4-Diaminopyridine

C5H7N3CAS 54-96-6109.13 g/mol

Open in Covalent MOL file
HNNHH2N
Primary amine

Properties

Molecular formula
C5H7N3
Molar mass
109.13 g/mol
Exact mass
109.0640 Da
Melting point
220 °C
logP
0.08Crippen estimate
Polar surface area
65.7 Ų
H-bond donors / acceptors
3 / 2
Rotatable bonds
0

Identifiers

CAS number
54-96-6
SMILES
N=c1cc[nH]cc1N
InChIKey
OYTKINVCDFNREN-UHFFFAOYSA-N
InChI
InChI=1S/C5H7N3/c6-4-1-2-8-3-5(4)7/h1-3H,7H2,(H2,6,8)

Weigh it out

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

Names and synonyms

9 names
  • 3,4-Pyridinediamine
  • Pyridine, 3,4-diamino-
  • 4,5-Diaminopyridine
  • NSC 521760
  • Amifampridine
  • Pyridine-4,5-diamine
  • DAP
  • 3,4-DAP
  • Ruzurgi

Work with 3,4-Diaminopyridine

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

3-Methyl-4-pyridinamine1990-90-550 % similar 4-Amino-3-hydroxypyridine52334-53-950 % similar 3-Iodo-4-pyridinamine88511-27-750 % similar 4-Amino-3-trifluoromethylpyridine387824-61-545 % similar 4-Amino-3-pyridinecarboxamide7418-66-842 % similar 4-Amino-3-nitropyridine1681-37-441 % similar 4-Aminonicotinic acid7418-65-741 % similar 4-Aminopyridine504-24-540 % similar

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

Same formula

2-Amino-4-methylpyrimidine108-52-1 2,6-Diaminopyridine141-86-6 3-Amino-6-methylpyridazine18591-82-7 3-Methyl-2-pyrazinamine19838-08-5 4-Amino-6-methylpyrimidine3435-28-7 2,5-Diaminopyridine4318-76-7 2,3-Diaminopyridine452-58-4 2,4-Diaminopyridine461-88-1

Elsewhere

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