2-[(2-Aminoethyl)amino]-5-nitropyridine

C₇H₁₀N₄O₂CAS 29602-39-9182.18 g/mol

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Nitro Primary amine

Properties

Molecular formula: C₇H₁₀N₄O₂
Molar mass: 182.18 g/mol
Exact mass: 182.0804 Da
Melting point: 123 °C
logP: -0.22Crippen estimate
Polar surface area: 97.3 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 3

Identifiers

CAS number

29602-39-9

SMILES

NCCN=c1ccc([N+](=O)[O-])c[nH]1

InChIKey

ODHSPTHLPCXPTL-UHFFFAOYSA-N

InChI

InChI=1S/C7H10N4O2/c8-3-4-9-7-2-1-6(5-10-7)11(12)13/h1-2,5H,3-4,8H2,(H,9,10)

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Names and synonyms

9 names

1,2-Ethanediamine, N1-(5-nitro-2-pyridinyl)-
Pyridine, 2-[(2-aminoethyl)amino]-5-nitro-
1,2-Ethanediamine, N-(5-nitro-2-pyridinyl)-
N1-(5-Nitro-2-pyridinyl)-1,2-ethanediamine
2-(β-Aminoethylamino)-5-nitropyridine
N1-(5-Nitropyrid-2-yl)ethane-1,2-diamine
(2-Aminoethyl)(5-nitro-2-pyridyl)amine
(2-((5-Nitropyridin-2-yl)amino)ethyl)amine
N-(5-Nitropyridin-2-yl)ethane-1,2-diamine

Work with 2-[(2-Aminoethyl)amino]-5-nitropyridine

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-Amino-5-nitropyridine4214-76-048 % similar 2-(4-Nitrophenyl)ethylamine hydrochloride29968-78-345 % similar 1,4-Dinitrobenzene100-25-441 % similar p-Nitrobenzylamine hydrochloride18600-42-540 % similar 4-Nitroaniline100-01-638 % similar 4,4′-Dinitro-1,1′-biphenyl1528-74-138 % similar (4-Nitrophenyl)hydrazine100-16-337 % similar 4-Amino-4′-nitroazobenzene730-40-536 % similar

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

Elsewhere

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