Nombre: 5-benzyl-3,3a,4,6-tetrahydro-2H-furo[2,3-c]pyrrole-6a-carbonitrile
SMILES:
C1COC2(C1CN(C2)CC3=CC=CC=C3)C#NMolecular Processing
Molecular formula
C14H16N2O
Molecular weight
228.3
Exact mass
228.1263
XLogP
1.8
TPSA
36.26
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
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
0.5
Molar refractivity
64.12
Supplementary Information
InChIKey: XOWRAUKILHCDBB-UHFFFAOYSA-N
Sinónimos
SCHEMBL7493585XOWRAUKILHCDBB-UHFFFAOYSA-N7-benzyl-1-cyano-2-oxa-7-aza-bicyclo[3.3.0]octane7-Benzyl-1-cyano-2-oxa-7-azabicyclo[3.3.0]octane
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