CN(C)c1ccc([N+](=O)[O-])c(N2CCCCC2)c1
名称: dimethyl-(4-nitro-3-piperidin-1-yl-phenyl)-amine
SMILES: CN(C)c1ccc([N+](=O)[O-])c(N2CCCCC2)c1

Molecular Processing

Molecular formula
C13H19N3O2
Molecular weight
249.31
Exact mass
249.1477
XLogP
2.65
TPSA
49.62
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
73.49

Supplementary Information

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