(2-methyl-1-(2-morpholino ethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl)(4-methylnaphthalen-1-yl)methanone

HCID 66764751
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Basic information

Standard SMILES
Cc1ccc(C(=O)c2c(C)n(CCN3CCOCC3)c3ncccc23)c2ccccc12
InChIKey
HFSHWEYYKYUQQE-UHFFFAOYSA-N
Molecular formula
C26H27N3O2
Average molar mass
413.5 g/mol
Monoisotopic mass
413.21032711

Names & identifiers

Preferred name
(2-methyl-1-(2-morpholino ethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl)(4-methylnaphthalen-1-yl)methanone
IUPAC
[2-methyl-1-(2-morpholin-4-ylethyl)pyrrolo[2,3-b]pyridin-3-yl]-(4-methylnaphthalen-1-yl)methanone

Names & synonyms

SCHEMBL670112CHEMBL5428392HFSHWEYYKYUQQE-UHFFFAOYSA-N(2-methyl-1-(2-morpholino ethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl)(4-methylnaphthalen-1-yl)methanone

Database identifiers

PubChem CID
66764751
ChEMBL
CHEMBL5428392

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
47.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
31

Related reactions

1 records
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Compound notes

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