Nombre: N-[(4-amino-2,3-dihydro-1H-inden-2-yl)methyl]propanamide
SMILES:
CCC(=O)NCC1CC2=C(C1)C(=CC=C2)NMolecular Processing
Molecular formula
C13H18N2O
Molecular weight
218.3
Exact mass
218.1419
XLogP
1.51
TPSA
55.12
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
65.05
Supplementary Information
InChIKey: PNBYKKFMJUSFNB-UHFFFAOYSA-N
Sinónimos
SCHEMBL1415963PNBYKKFMJUSFNB-UHFFFAOYSA-NN-(4-Amino-indan-2-ylmethyl)-propionamide
Participa en 2 reacciones→