1-Benzyl-3-(3-chloro-phenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine

HCID 53316609

Notes Reactions

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Basic information

Standard SMILES: Clc1cccc(-c2cn(Cc3ccccc3)c3c2CNCC3)c1
InChIKey: MABFHWXLMDXVQO-UHFFFAOYSA-N
Molecular formula: C20H19ClN2
Average molar mass: 322.8 g/mol

Names & identifiers

Preferred name: 1-Benzyl-3-(3-chloro-phenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine
IUPAC: 1-benzyl-3-(3-chlorophenyl)-4,5,6,7-tetrahydropyrrolo[3,2-c]pyridine

Names & synonyms

CHEMBL1644277SCHEMBL2074348MABFHWXLMDXVQO-UHFFFAOYSA-NBDBM503345261-Benzyl-3-(3-chloro-phenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine1-benzyl-3-(3-chlorophenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine

Database identifiers

PubChem CID: 53316609
ChEMBL: CHEMBL1644277

Properties

Computed structural properties

XLogP: 4
Topological polar surface area: 17 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 3
Heavy atoms: 23
Formal charge: 0
Complexity: 382

Related reactions

3 records

New reaction record

HRID 599896As productuspto-grants-2011_03

HRID 749723As productuspto-grants-2008_07

HRID 2106205As productuspto-grants-2009_08

Compound notes

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