名称: N-[9-[(4-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-ylidene]hydroxylamine
SMILES:
CC1=CC=C(C=C1)CN2C3CCCC2CC(=NO)C3Molecular Processing
Molecular formula
C16H22N2O
Molecular weight
258.37
Exact mass
258.1732
XLogP
3.34
TPSA
35.83
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
76.6
Supplementary Information
InChIKey: KQFNVXOEIYBQNZ-UHFFFAOYSA-N
同義語
SCHEMBL10815843KQFNVXOEIYBQNZ-UHFFFAOYSA-N9-(4-Methylbenzyl)-9-aza-bicyclo-[3.3.1]-nonan-3-one oxime
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