NCCC1(OC2CCCCO2)CCCCC1
Nom: 2-[1-(oxan-2-yloxy)cyclohexyl]ethanamine
SMILES: NCCC1(OC2CCCCO2)CCCCC1

Molecular Processing

Molecular formula
C13H25NO2
Molecular weight
227.35
Exact mass
227.1885
XLogP
2.58
TPSA
44.48
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
1
Molar refractivity
64.16

Supplementary Information

InChIKey: GEIQDBIFOQFULU-UHFFFAOYSA-N
Synonymes
SCHEMBL11254038GEIQDBIFOQFULU-UHFFFAOYSA-N1-Amino-2-[1-(tetrahydro-2H-pyran-2-yloxy)cyclohexyl]ethane
Voir la source →
Impliqué dans 2 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→