CCCNCC1=CC(NC2=C1C=C(C=C2)C3=CC=CC=C3OC)(C)C
이름: N-[[6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinolin-4-yl]methyl]propan-1-amine
SMILES: CCCNCC1=CC(NC2=C1C=C(C=C2)C3=CC=CC=C3OC)(C)C

Molecular Processing

Molecular formula
C22H28N2O
Molecular weight
336.48
Exact mass
336.2202
XLogP
4.95
TPSA
33.29
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
107.27

Supplementary Information

InChIKey: WJOHCLSIXGADDA-UHFFFAOYSA-N
동의어
SCHEMBL4703266WJOHCLSIXGADDA-UHFFFAOYSA-N[6-(2-Methoxyphenyl)-2,2-dimethyl-1,2-dihydroquinolin-4-ylmethyl]propylamine
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