(2R)-N-cyclopropyl-N-{(1S)-1-[4-(3-methoxypropoxy)-1-benzofuran-6-yl]ethyl}morpholine-2-carboxamide

HCID 68308680

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Basic information

Standard SMILES: COCCCOc1cc([C@H](C)N(C(=O)[C@H]2CNCCO2)C2CC2)cc2occc12
InChIKey: RNDPRUVTGHOKOT-YCRPNKLZSA-N
Molecular formula: C22H30N2O5
Average molar mass: 402.5 g/mol

Names & identifiers

Preferred name: (2R)-N-cyclopropyl-N-{(1S)-1-[4-(3-methoxypropoxy)-1-benzofuran-6-yl]ethyl}morpholine-2-carboxamide
IUPAC: (2R)-N-cyclopropyl-N-[(1S)-1-[4-(3-methoxypropoxy)-1-benzofuran-6-yl]ethyl]morpholine-2-carboxamide

Names & synonyms

CHEMBL3892067SCHEMBL12523953RNDPRUVTGHOKOT-YCRPNKLZSA-NBDBM212490US9278944, 44(2R)-N-cyclopropyl-N-{(1S)-1-[4-(3-methoxypropoxy)-1-benzofuran-6-yl]ethyl}morpholine-2-carboxamide

Database identifiers

PubChem CID: 68308680
ChEMBL: CHEMBL3892067

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 73.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 9
Heavy atoms: 29
Formal charge: 0
Complexity: 543

Related reactions

1 records

New reaction record

HRID 922411As productuspto-grants-2016_03

Compound notes

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