C1CNCCC12C(=O)NCN2C3=CC=C(C=C3)F
CAS: 58012-16-1
Nombre: 1-(4-fluorophenyl)-1,3,8-triazaspiro[4.5]decan-4-one
SMILES: C1CNCCC12C(=O)NCN2C3=CC=C(C=C3)F

Molecular Processing

Molecular formula
C13H16FN3O
Molecular weight
249.29
Exact mass
249.1277
XLogP
0.84
TPSA
44.37
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
66.72

Supplementary Information

InChIKey: BEEPXSBZGLKIOT-UHFFFAOYSA-N
Sinónimos
1-(4-fluorophenyl)-1,3,8-triazaspiro[4.5]decan-4-one58012-16-11-(4-Fluorophenyl)-1,3,8-triazaspiro(4,5)decan-4-oneDTXSID302067351-(4-fluorophenyl)-1,3,8-triazaspiro[4,5]decan-4-one1-(4-Fluorophenyl)-1,3,8-triazaspiro(4.5)decan-4-oneRefChem:1054362DTXCID60129226261-071-3MFCD18711452EINECS 261-071-3SCHEMBL318959TQP0839AKOS022664108AS-35671DB-328573CS-0091752NS00053345F3013591-(p-fluorophenyl)-1,3,8-triazaspiro[4,5]decan-4-one1-(p-fluorophenyl)-1,3,8-triazaspiro[4.5]decan-4-one1-(4-Fluoro-phenyl)-1,3,8-triaza-spiro[4.5]decan-4-one
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