3-(1-Oxoisoquinolin-2(1H)-yl)-N-cyclopropyl-4-methylbenzamide

HCID 11587767
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Basic information

Standard SMILES
Cc1ccc(C(=O)NC2CC2)cc1-n1ccc2ccccc2c1=O
InChIKey
ZBORZZZJTSHWTI-UHFFFAOYSA-N
Molecular formula
C20H18N2O2
Average molar mass
318.4 g/mol

Names & identifiers

Preferred name
3-(1-Oxoisoquinolin-2(1H)-yl)-N-cyclopropyl-4-methylbenzamide
IUPAC
N-cyclopropyl-4-methyl-3-(1-oxoisoquinolin-2-yl)benzamide

Names & synonyms

SCHEMBL1399883ZBORZZZJTSHWTI-UHFFFAOYSA-N3-(1-Oxoisoquinolin-2(1H)-yl)-N-cyclopropyl-4-methylbenzamide

Database identifiers

PubChem CID
11587767

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
49.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
24

Related reactions

1 records
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Compound notes

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