CC1(CCC(CC1)C2=CC=CC=C2N3CCNCC3)C
이름: 1-[2-(4,4-dimethylcyclohexyl)phenyl]piperazine
SMILES: CC1(CCC(CC1)C2=CC=CC=C2N3CCNCC3)C

Molecular Processing

Molecular formula
C18H28N2
Molecular weight
272.44
Exact mass
272.2252
XLogP
3.78
TPSA
15.27
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
86.51

Supplementary Information

InChIKey: XGDYDDWVKJWQJV-UHFFFAOYSA-N
동의어
SCHEMBL4258576SCHEMBL6022687XGDYDDWVKJWQJV-UHFFFAOYSA-N1-[2-(4,4-dimethylcyclohexyl)phenyl]piperazine
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