N-(2-amino-1-methylpropyl)-5-isoquinolinesulfonamide

HCID 20159892
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Basic information

Standard SMILES
CC(N)C(C)NS(=O)(=O)c1cccc2cnccc12
InChIKey
NTVCSNVBARONCV-UHFFFAOYSA-N
Molecular formula
C13H17N3O2S
Average molar mass
279.36 g/mol

Names & identifiers

Preferred name
N-(2-amino-1-methylpropyl)-5-isoquinolinesulfonamide
IUPAC
N-(3-aminobutan-2-yl)isoquinoline-5-sulfonamide

Names & synonyms

SCHEMBL7435892NTVCSNVBARONCV-UHFFFAOYSA-NN-(2-amino-1-methylpropyl)-5-isoquinolinesulfonamide

Database identifiers

PubChem CID
20159892

Properties

Computed structural properties

XLogP
1
Topological polar surface area
93.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
19

Related reactions

3 records
New reaction record

Compound notes

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