Name: 1-amino-3,5-dimethyl-7-hydroxymethyl adamantane
SMILES:
CC12CC3(C)CC(N)(C1)CC(CO)(C2)C3Molecular Processing
Molecular formula
C13H23NO
Molecular weight
209.33
Exact mass
209.178
XLogP
2.06
TPSA
46.25
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
15
Rings
4
Aromatic rings
0
Saturated rings
4
Aliphatic rings
4
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
1
Molar refractivity
60.35
Supplementary Information
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