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1-(2-azidopropyl)-7-methoxy-4H-indeno[1,2-b]pyrrole

HCID 10754367
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Basic information

Standard SMILES
COc1ccc2c(c1)-c1c(ccn1CC(C)N=[N+]=[N-])C2
InChIKey
DWTBJXRFERVXHD-UHFFFAOYSA-N
Molecular formula
C15H16N4O
Average molar mass
268.31 g/mol

Names & identifiers

Preferred name
1-(2-azidopropyl)-7-methoxy-4H-indeno[1,2-b]pyrrole
IUPAC
1-(2-azidopropyl)-7-methoxy-4H-indeno[1,2-b]pyrrole

Database identifiers

PubChem CID
10754367

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
28.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
Formal charge
0
Complexity
395

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Related reactions

1 records
New reaction record
HRID 2154135 reaction equation
HRID 2154135As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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