C1CNCC2C1C(=O)NC2
CAS: 1391926-56-9
Name: 2,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridin-1-one
SMILES: C1CNCC2C1C(=O)NC2

Molecular Processing

Molecular formula
C7H12N2O
Molecular weight
140.19
Exact mass
140.095
XLogP
-0.66
TPSA
41.13
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
10
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
37.48

Supplementary Information

InChIKey: XLHNWTSCXPCOMK-UHFFFAOYSA-N
Synonyme
octahydro-1H-pyrrolo[3,4-c]pyridin-1-one1391926-56-92,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridin-1-oneMFCD24506785SCHEMBL12499651SCHEMBL24971058XLHNWTSCXPCOMK-UHFFFAOYSA-NTJB58536SB15892SY351150CS-0056674EN300-216893P13958
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