2-(pyridin-3-ylcarbonyl)-N-3-thienyl-1,2,3,4-tetrahydroisoquinolin-6-amine

HCID 118970907
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Basic information

Standard SMILES
O=C(c1cccnc1)N1CCc2cc(Nc3ccsc3)ccc2C1
InChIKey
PKBWMHKCIGTDCK-UHFFFAOYSA-N
Molecular formula
C19H17N3OS
Average molar mass
335.4 g/mol
Monoisotopic mass
335.10923335

Names & identifiers

Preferred name
2-(pyridin-3-ylcarbonyl)-N-3-thienyl-1,2,3,4-tetrahydroisoquinolin-6-amine
IUPAC
pyridin-3-yl-[6-(thiophen-3-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]methanone

Names & synonyms

SCHEMBL17620627PKBWMHKCIGTDCK-UHFFFAOYSA-N2-(pyridin-3-ylcarbonyl)-N-3-thienyl-1,2,3,4-tetrahydroisoquinolin-6-amine

Database identifiers

PubChem CID
118970907

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
73.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
24

Related reactions

1 records
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Compound notes

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