N,N-dimethyl-3-[(benzo[1,3]dioxolan-4-yl)-oxy]-3-(thiophen-2-yl)-propylamine

HCID 44595220
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Basic information

Standard SMILES
CN(C)CCC(Oc1cccc2c1OCO2)c1cccs1
InChIKey
WCXHJAPANPXSBH-UHFFFAOYSA-N
Molecular formula
C16H19NO3S
Average molar mass
305.4 g/mol
Monoisotopic mass
305.10856464

Names & identifiers

Preferred name
N,N-dimethyl-3-[(benzo[1,3]dioxolan-4-yl)-oxy]-3-(thiophen-2-yl)-propylamine
IUPAC
3-(1,3-benzodioxol-4-yloxy)-N,N-dimethyl-3-thiophen-2-ylpropan-1-amine

Names & synonyms

SCHEMBL1556723WCXHJAPANPXSBH-UHFFFAOYSA-NN,N-dimethyl-3-[(benzo[1,3]dioxolan-4-yl)-oxy]-3-(thiophen-2-yl)-propylamine

Database identifiers

PubChem CID
44595220

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
59.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
21

Related reactions

2 records
New reaction record

Compound notes

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