Name: 4-(tert-butoxycarbonyl)-hexahydro-2-methyl-1H-1,4-diazepine
SMILES:
CC1CN(C(=O)OC(C)(C)C)CCCN1Molecular Processing
Molecular formula
C11H22N2O2
Molecular weight
214.31
Exact mass
214.1681
XLogP
1.61
TPSA
41.57
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
15
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
0.909
Molar refractivity
59.89
Supplementary Information
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