N-[(4-methylphenyl)methyl]-9H-xanthene-9-carboxamide

HCID 742999

Notes Reactions

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Basic information

Standard SMILES: Cc1ccc(CNC(=O)C2c3ccccc3Oc3ccccc32)cc1
InChIKey: OALHCRBYIUYDHE-UHFFFAOYSA-N
Molecular formula: C22H19NO2
Average molar mass: 329.4 g/mol
Monoisotopic mass: 329.14157885

Names & identifiers

Preferred name: N-[(4-methylphenyl)methyl]-9H-xanthene-9-carboxamide
IUPAC: N-[(4-methylphenyl)methyl]-9H-xanthene-9-carboxamide

Names & synonyms

N-[(4-methylphenyl)methyl]-9H-xanthene-9-carboxamideN-(4-methylbenzyl)-9H-xanthene-9-carboxamideChemDiv3_001186Oprea1_366815Oprea1_477635HMS1476F20STK009258AKOS000644437IDI1_020152NCGC00172909-01EU-0071389ST50703168

Show more names

N-[(4-methylphenyl)methyl]xanthen-9-ylcarboxamideBRD-K28794654-001-01-8Z28429511

Database identifiers

PubChem CID: 742999

Properties

Computed structural properties

XLogP: 3.8
Topological polar surface area: 38.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 25
Formal charge: 0
Complexity: 435

Related reactions

92 records

New reaction record

HRID 752392As productAIChemEco amide coupling conditions 47k dataset

HRID 752735As productAIChemEco amide coupling conditions 47k dataset

HRID 753160As productAIChemEco amide coupling conditions 47k dataset

HRID 753894As productAIChemEco amide coupling conditions 47k dataset

HRID 754750As productAIChemEco amide coupling conditions 47k dataset

HRID 755064As productAIChemEco amide coupling conditions 47k dataset

HRID 755780As productAIChemEco amide coupling conditions 47k dataset

HRID 756213As productAIChemEco amide coupling conditions 47k dataset

Compound notes

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