7-Iodo-1,1-dimethyl-1,2,3,4-tetrahydro-benzo[4,5]furo[2,3-c]pyridine

HCID 67323748
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC1(C)NCCc2c1oc1cc(I)ccc21
InChIKey
XLXKARBOUIZJQD-UHFFFAOYSA-N
Molecular formula
C13H14INO
Average molar mass
327.16 g/mol
Monoisotopic mass
327.01201

Names & identifiers

Preferred name
7-Iodo-1,1-dimethyl-1,2,3,4-tetrahydro-benzo[4,5]furo[2,3-c]pyridine
IUPAC
7-iodo-1,1-dimethyl-3,4-dihydro-2H-[1]benzofuro[2,3-c]pyridine

Names & synonyms

SCHEMBL2224595XLXKARBOUIZJQD-UHFFFAOYSA-N7-iodo-1,1-dimethyl-1,2,3,4-tetrahydro-benzo[4,5]furo[2,3-c]pyridine

Database identifiers

PubChem CID
67323748

Properties

Computed structural properties

XLogP
3
Topological polar surface area
25.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
16

Related reactions

1 records
New reaction record

Compound notes

Loading…