CC1=CC=CC=C1C2CCN(CC2)CC3CNCC3C4=CC=CC=C4
Name: 4-(2-methylphenyl)-1-[(4-phenylpyrrolidin-3-yl)methyl]piperidine
SMILES: CC1=CC=CC=C1C2CCN(CC2)CC3CNCC3C4=CC=CC=C4

Molecular Processing

Molecular formula
C23H30N2
Molecular weight
334.51
Exact mass
334.2409
XLogP
4.18
TPSA
15.27
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.478
Molar refractivity
105.14

Supplementary Information

InChIKey: PQVHSFOQTVOHRE-UHFFFAOYSA-N
Synonyms
SCHEMBL7828999PQVHSFOQTVOHRE-UHFFFAOYSA-N3-(SR)-(4-(2-tolyl)-piperidin-1-ylmethyl)-4-(SR)-phenylpyrrolidine
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Involved in 3 reactions→

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