C1CN(CCN1)C2=C(C=CC=N2)[N+](=O)[O-]
CAS: 87394-48-7
Nom: 1-(3-nitro-2-pyridinyl)piperazine
SMILES: C1CN(CCN1)C2=C(C=CC=N2)[N+](=O)[O-]

Molecular Processing

Molecular formula
C9H12N4O2
Molecular weight
208.22
Exact mass
208.096
XLogP
0.4
TPSA
71.3
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
55.97

Supplementary Information

InChIKey: HSAKGWZDXDRYTB-UHFFFAOYSA-N
Synonymes
1-(3-nitropyridin-2-yl)piperazine87394-48-7DTXSID50396304RefChem:224581DTXCID403471631-(3-Nitorpyridin-2-yl)piperazine1-(3-nitro-2-pyridyl)piperazine1-(3-nitro-2-pyridinyl)piperazineMFCD051822271-(3-Nitro-pyridin-2-yl)-piperazineCHEMBL296653piperazine, 1-(3-nitro-2-pyridinyl)-, dihydrochloride1-(3-nitro-pyridin-2-yl)piperazine1-(3-Nitorpyridin-2-yl)piperazine2-yl)piperazine(3-nitro-2-pyridyl)piperazineSCHEMBL2898307HSAKGWZDXDRYTB-UHFFFAOYSA-NALBB-0130822-(1-Piperazinyl)-3-nitropyridineBDBM50027020EBC-03676GS0769SBB0557361-(3--Nitro-2-pyridinyl)piperazineAKOS000123163AKOS015940997AS-9019CS-0096054EN300-41963F034171
Voir la source →
Impliqué dans 27 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→