CCC1CN(C(=O)OC(C)(C)C)CCCN1
Name: 1-(tert-butoxycarbonyl)-3-ethyl-hexahydro-1H-1,4-diazepine
SMILES: CCC1CN(C(=O)OC(C)(C)C)CCCN1

Molecular Processing

Molecular formula
C12H24N2O2
Molecular weight
228.34
Exact mass
228.1838
XLogP
2
TPSA
41.57
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.917
Molar refractivity
64.51

Supplementary Information

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