N,N-dimethyl-4-(hydroxymethyloxy)benzo(b)thiophene-2-carboxamide

HCID 22729338
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Basic information

Standard SMILES
CN(C)C(=O)c1cc2c(OCO)cccc2s1
InChIKey
FQOBXOGKFNOAAS-UHFFFAOYSA-N
Molecular formula
C12H13NO3S
Average molar mass
251.3 g/mol
Monoisotopic mass
251.06161445

Names & identifiers

Preferred name
N,N-dimethyl-4-(hydroxymethyloxy)benzo(b)thiophene-2-carboxamide
IUPAC
4-(hydroxymethoxy)-N,N-dimethyl-1-benzothiophene-2-carboxamide

Names & synonyms

SCHEMBL5584523FQOBXOGKFNOAAS-UHFFFAOYSA-NN,N-dimethyl-4-(hydroxymethyloxy)benzo(b)thiophene-2-carboxamideN,N-dimethyl-4-(hydroxymethyloxy)benzo-(b)thiophene-2-carboxamide

Database identifiers

PubChem CID
22729338

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
78 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
17

Related reactions

2 records
New reaction record

Compound notes

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