[5-(3-Chloro-propoxy)-1H-pyrrolo[2,3-b]pyridin-2-yl]-(4,4-difluoro-piperidin-1-yl)-methanone

HCID 68424352
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Basic information

Standard SMILES
O=C(c1cc2cc(OCCCCl)cnc2[nH]1)N1CCC(F)(F)CC1
InChIKey
YOCRBRFHHUEADS-UHFFFAOYSA-N
Molecular formula
C16H18ClF2N3O2
Average molar mass
357.78 g/mol

Names & identifiers

Preferred name
[5-(3-Chloro-propoxy)-1H-pyrrolo[2,3-b]pyridin-2-yl]-(4,4-difluoro-piperidin-1-yl)-methanone
IUPAC
[5-(3-chloropropoxy)-1H-pyrrolo[2,3-b]pyridin-2-yl]-(4,4-difluoropiperidin-1-yl)methanone

Names & synonyms

[5-(3-Chloro-propoxy)-1H-pyrrolo[2,3-b]pyridin-2-yl]-(4,4-difluoro-piperidin-1-yl)-methanoneSCHEMBL2875419

Database identifiers

PubChem CID
68424352

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
58.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
24

Related reactions

6 records
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Compound notes

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