trivial
CUMYL-THPINACA
systemic
N-(2-phenylpropan-2-yl)-1-((tetrahydro-2H-pyran-4-yl)methyl)-1-H-indazole-3-carboxamide
1-(oxan-4-ylmethyl)-N-(2-phenylpropan-2-yl)indazole-3-carboxamide
CUMYL-THPINACA
systemic
N-(2-phenylpropan-2-yl)-1-((tetrahydro-2H-pyran-4-yl)methyl)-1-H-indazole-3-carboxamide
1-(oxan-4-ylmethyl)-N-(2-phenylpropan-2-yl)indazole-3-carboxamide
Identifiers
InChIKey: HINCNLQQLQFMRD-UHFFFAOYSA-N
Formula: C23H27N3O2
CAS Registry numbers:
1400742-50-8
Descriptors
Bioavailability-related
Molecular weight: 377.21 DaPartition coefficient: 4.13
H bond donors: 1
H bond acceptors: 5
Rotatable bonds: 6
Molar refractivity: 110.21 J mol-1 K-1
Polar surface area: 56.15 Å2
Generic
Stereocenters: 0Heteroatoms: 5
Spiroatoms: 0
Bridge atoms: 0
Amide bonds: 1
Ring-related
Rings: 4Heterocycles: 2
Aromatic rings: 3
Aromatic carbocycles: 2
Aromatic heterocycles: 1
Aliphatic rings: 1
Aliphatic carbocycles: 0
Aliphatic heterocycles: 1