N-(4-morpholinophenyl)benzo[d][1,3]dioxole-5-carboxamide
Basic information
- CAS
6071-77-8- Standard SMILES
O=C(Nc1ccc(N2CCOCC2)cc1)c1ccc2c(c1)OCO2- InChIKey
VLUGKIVWCFYLBR-UHFFFAOYSA-N- Molecular formula
- C18H18N2O4
- Average molar mass
- 326.3 g/mol
- Monoisotopic mass
- 326.12665706
Names & identifiers
- Preferred name
- N-(4-morpholinophenyl)benzo[d][1,3]dioxole-5-carboxamide
- IUPAC
- N-(4-morpholin-4-ylphenyl)-1,3-benzodioxole-5-carboxamide
Names & synonyms
325694-77-7N-(4-morpholinophenyl)benzo[d][1,3]dioxole-5-carboxamideN-[4-(MORPHOLIN-4-YL)PHENYL]-2H-1,3-BENZODIOXOLE-5-CARBOXAMIDE6071-77-8N-(4-morpholin-4-ylphenyl)-1,3-benzodioxole-5-carboxamideVLUGKIVWCFYLBR-UHFFFAOYSA-NCBMicro_043876Cambridge id 6071778Oprea1_057439Oprea1_506225MLS000677330CHEMBL1374725
Show more names
DTXSID00976155HMS2648B10STK231738AKOS000474934UPCMLD0ENAT5818500:001SMR000286118BIM-0044143.P001ST50742167
Database identifiers
- CAS
6071-77-8- PubChem CID
- 784456
- DTXSID
DTXSID00976155- ChEMBL
CHEMBL1374725
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 60 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 433
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Compound notes
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