Basic information
- Standard SMILES
O=C1NCC2CCNCC12- InChIKey
SXNMNJGBKPGDPH-UHFFFAOYSA-N- Molecular formula
- C7H12N2O
- Average molar mass
- 140.18 g/mol
Names & identifiers
- Preferred name
- (3Ar,7ar)-rel-octahydro-3h-pyrrolo[3,4-c]pyridin-3-one
- IUPAC
- 1,2,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridin-3-one
Names & synonyms
1083223-83-9OCTAHYDRO-1H-PYRROLO[3,4-C]PYRIDIN-3-ONE1,2,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridin-3-one(3ar,7ar)-rel-octahydro-3h-pyrrolo[3,4-c]pyridin-3-one(3aR,7aR)-rel-Octahydro-3H-pyrrolo-[3,4-c]pyridin-3-onecis-1,2,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridin-3-oneMFCD28975426Hexahydro-1H-pyrrolo[3,4-c]pyridin-3(2H)-oneSCHEMBL397520SCHEMBL23361144SXNMNJGBKPGDPH-UHFFFAOYSA-NMFCD24496372
Show more names
AT28348PB22670SB10538SB74222SY404354cis-Octahydropyrrolo[3,4-c]pyridin-3-oneEN300-364293OCTAHYDRO-3H-PYRROLO[3,4-C]PYRIDIN-3-ONE
Database identifiers
- PubChem CID
- 66675741
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 158
Related reactions
1 records
Compound notes
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