(7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone

C20H19NO4 — CID 90675788

IUPAC(7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone
SMILESCOc1ccc(-c2ccccc2)c2cc(C(=O)N3CCOCC3)oc12
InChIInChI=1S/C20H19NO4/c1-23-17-8-7-15(14-5-3-2-4-6-14)16-13-18(25-19(16)17)20(22)21-9-11-24-12-10-21/h2-8,13H,9-12H2,1H3
InChIKeyMNDYIAJHMUZJFH-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.58
Rot. Bonds3

About (7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone

(7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone (PubChem CID 90675788) has the molecular formula C20H19NO4 and a molecular weight of 337.38 g/mol. Its IUPAC name is (7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone
PubChem CID90675788
Molecular FormulaC20H19NO4
Molecular Weight337.38 g/mol
Exact Mass337.13
IUPAC Name(7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone
SMILESCOc1ccc(-c2ccccc2)c2cc(C(=O)N3CCOCC3)oc12
InChIInChI=1S/C20H19NO4/c1-23-17-8-7-15(14-5-3-2-4-6-14)16-13-18(25-19(16)17)20(22)21-9-11-24-12-10-21/h2-8,13H,9-12H2,1H3
InChIKeyMNDYIAJHMUZJFH-UHFFFAOYSA-N
XLogP3.58
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone?
The IUPAC name of (7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone (CID 90675788) is (7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone is COc1ccc(-c2ccccc2)c2cc(C(=O)N3CCOCC3)oc12.
What is the InChIKey of (7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone?
The InChIKey is MNDYIAJHMUZJFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO4/c1-23-17-8-7-15(14-5-3-2-4-6-14)16-13-18(25-19(16)17)20(22)21-9-11-24-12-10-21/h2-8,13H,9-12H2,1H3.
What are the key properties of (7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone?
(7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone has a molecular weight of 337.38 g/mol, XLogP of 3.58, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methoxy-4-phenyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 90675788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).