2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone

C19H19NO3 — CID 71993262

IUPAC2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone
SMILESO=C(C1COc2ccccc21)N1CCOCC1c1ccccc1
InChIInChI=1S/C19H19NO3/c21-19(16-12-23-18-9-5-4-8-15(16)18)20-10-11-22-13-17(20)14-6-2-1-3-7-14/h1-9,16-17H,10-13H2
InChIKeyUIRHHTBVDBBEGU-UHFFFAOYSA-N
MW309.36 g/mol
LogP2.76
Rot. Bonds2

About 2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone

2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone (PubChem CID 71993262) has the molecular formula C19H19NO3 and a molecular weight of 309.36 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone
PubChem CID71993262
Molecular FormulaC19H19NO3
Molecular Weight309.36 g/mol
Exact Mass309.14
IUPAC Name2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone
SMILESO=C(C1COc2ccccc21)N1CCOCC1c1ccccc1
InChIInChI=1S/C19H19NO3/c21-19(16-12-23-18-9-5-4-8-15(16)18)20-10-11-22-13-17(20)14-6-2-1-3-7-14/h1-9,16-17H,10-13H2
InChIKeyUIRHHTBVDBBEGU-UHFFFAOYSA-N
XLogP2.76
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.36
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone?
The IUPAC name of 2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone (CID 71993262) is 2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone?
The canonical SMILES for 2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone is O=C(C1COc2ccccc21)N1CCOCC1c1ccccc1.
What is the InChIKey of 2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone?
The InChIKey is UIRHHTBVDBBEGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO3/c21-19(16-12-23-18-9-5-4-8-15(16)18)20-10-11-22-13-17(20)14-6-2-1-3-7-14/h1-9,16-17H,10-13H2.
What are the key properties of 2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone?
2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone has a molecular weight of 309.36 g/mol, XLogP of 2.76, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-3-yl-(3-phenylmorpholin-4-yl)methanone is sourced from PubChem (CID 71993262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).