2-(3-(3,3-dimethylmorpholino)quinoxalin-5-yl)-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-one
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Basic information
- Standard SMILES
CC1(C)COCCN1c1cnc2cccc(-c3cc4c([nH]3)CCNC4=O)c2n1- InChIKey
YCTLFFABXKWHMV-UHFFFAOYSA-N- Molecular formula
- C21H23N5O2
- Average molar mass
- 377.4 g/mol
Names & identifiers
- Preferred name
- 2-(3-(3,3-dimethylmorpholino)quinoxalin-5-yl)-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-one
- IUPAC
- 2-[3-(3,3-dimethylmorpholin-4-yl)quinoxalin-5-yl]-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
Names & synonyms
CHEMBL3963777SCHEMBL15232013YCTLFFABXKWHMV-UHFFFAOYSA-NBDBM238566US9394297, 2132-(3-(3,3-dimethylmorpholino)quinoxalin-5-yl)-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-one
Database identifiers
- PubChem CID
- 89784602
- ChEMBL
CHEMBL3963777
Properties
Computed structural propertiesFilling in
- XLogP
- 1.7
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 599
Related reactions
1 records
Compound notes
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