CCCNN(C(=O)OC(C)(C)C)c1cccc(C#N)c1
SMILES: CCCNN(C(=O)OC(C)(C)C)c1cccc(C#N)c1

Molecular Processing

Molecular formula
C15H21N3O2
Molecular weight
275.35
Exact mass
275.1634
XLogP
3.21
TPSA
65.36
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
78.16

Supplementary Information

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