1-Benzyl-piperidin-4-yl 3-iodo-benzoate

HCID 18919862
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Basic information

Standard SMILES
O=C(OC1CCN(Cc2ccccc2)CC1)c1cccc(I)c1
InChIKey
SUCUAAYDAHJDID-UHFFFAOYSA-N
Molecular formula
C19H20INO2
Average molar mass
421.3 g/mol
Monoisotopic mass
421.05388

Names & identifiers

Preferred name
1-Benzyl-piperidin-4-yl 3-iodo-benzoate
IUPAC
(1-benzylpiperidin-4-yl) 3-iodobenzoate

Names & synonyms

SCHEMBL8551771SUCUAAYDAHJDID-UHFFFAOYSA-N1-benzyl-piperidin-4-yl 3-iodo-benzoate

Database identifiers

PubChem CID
18919862

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
29.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
23

Related reactions

2 records
New reaction record

Compound notes

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