6-(4-Fluorobenzyl)-3,3-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine
Basic information
- Standard SMILES
CC1(C)CNc2cc(Cc3ccc(F)cc3)cnc21- InChIKey
YWRBKTXKHVEDDP-UHFFFAOYSA-N- Molecular formula
- C16H17FN2
- Average molar mass
- 256.32 g/mol
Names & identifiers
- Preferred name
- 6-(4-Fluorobenzyl)-3,3-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine
- IUPAC
- 6-[(4-fluorophenyl)methyl]-3,3-dimethyl-1,2-dihydropyrrolo[3,2-b]pyridine
Names & synonyms
1403903-11-66-(4-Fluorobenzyl)-3,3-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine6-[(4-fluorophenyl)methyl]-3,3-dimethyl-1H,2H,3H-pyrrolo[3,2-b]pyridineSCHEMBL13732966SCHEMBL29713514TQR0887YWRBKTXKHVEDDP-UHFFFAOYSA-NMFCD328686826-[(4-fluorophenyl)methyl]-3,3-dimethyl-1,2-dihydropyrrolo[3,2-b]pyridineAT50994SY514553DB-186046
Show more names
CS-01205246-(4-Fluorobenzyl)-3,3-dimethyl-2,3-dihydro-4-azaindole6-(4-Fluoro-benzyl)-3,3-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-b]pyridine6-(4-Fluorobenzyl)-2,3-dihydro-3,3-dimethyl-1h-pyrrolo[3,2-b]pyridine
Database identifiers
- PubChem CID
- 70980652
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 310
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Related reactions
3 records
Compound notes
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