N-(5-bromo-4-(3-(dimethylamino)piperidin-1-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl)nicotinamide

HCID 44517239
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Basic information

Standard SMILES
CN(C)C1CCCN(c2c(Br)cnc3[nH]cc(NC(=O)c4cccnc4)c23)C1
InChIKey
MMMDZLKGYAONJF-UHFFFAOYSA-N
Molecular formula
C20H23BrN6O
Average molar mass
443.3 g/mol

Names & identifiers

Preferred name
N-(5-bromo-4-(3-(dimethylamino)piperidin-1-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl)nicotinamide
IUPAC
N-[5-bromo-4-[3-(dimethylamino)piperidin-1-yl]-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide

Names & synonyms

SCHEMBL1468592MMMDZLKGYAONJF-UHFFFAOYSA-NN-(5-bromo-4-(3-(dimethylamino)piperidin-1-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl)nicotinamide

Database identifiers

PubChem CID
44517239

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
77.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
28

Related reactions

6 records
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Compound notes

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