O=C(NCC1CCNC1)OCc1ccccc1
SMILES: O=C(NCC1CCNC1)OCc1ccccc1

Molecular Processing

Molecular formula
C13H18N2O2
Molecular weight
234.3
Exact mass
234.1368
XLogP
1.52
TPSA
50.36
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
65.61

Supplementary Information

Details werden geladen…

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