CN(C)C1(CCC(=O)CC1)CC2=CC=CC=C2
CAS: 475098-34-1
Name: 4-benzyl-4-(dimethylamino)cyclohexan-1-one
SMILES: CN(C)C1(CCC(=O)CC1)CC2=CC=CC=C2

Molecular Processing

Molecular formula
C15H21NO
Molecular weight
231.34
Exact mass
231.1623
XLogP
2.67
TPSA
20.31
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
70.04

Supplementary Information

InChIKey: SOQQQHJQTOJEOW-UHFFFAOYSA-N
Synonyme
4-benzyl-4-(dimethylamino)cyclohexanoneSCHEMBL208815SOQQQHJQTOJEOW-UHFFFAOYSA-N4-benzyl-4-dimethylaminocyclohexanone4-benzyl-4-dimethylamino-cyclohexanone475098-34-1DB-166936
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