(5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone

C19H17NO4 — CID 745548

IUPAC(5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone
SMILESO=C(c1c(-c2ccccc2)oc2ccc(O)cc12)N1CCOCC1
InChIInChI=1S/C19H17NO4/c21-14-6-7-16-15(12-14)17(19(22)20-8-10-23-11-9-20)18(24-16)13-4-2-1-3-5-13/h1-7,12,21H,8-11H2
InChIKeyKYBZDPDOJLSNSO-UHFFFAOYSA-N
MW323.35 g/mol
LogP3.28
Rot. Bonds2

About (5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone

(5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone (PubChem CID 745548) has the molecular formula C19H17NO4 and a molecular weight of 323.35 g/mol. Its IUPAC name is (5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone
PubChem CID745548
Molecular FormulaC19H17NO4
Molecular Weight323.35 g/mol
Exact Mass323.12
IUPAC Name(5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone
SMILESO=C(c1c(-c2ccccc2)oc2ccc(O)cc12)N1CCOCC1
InChIInChI=1S/C19H17NO4/c21-14-6-7-16-15(12-14)17(19(22)20-8-10-23-11-9-20)18(24-16)13-4-2-1-3-5-13/h1-7,12,21H,8-11H2
InChIKeyKYBZDPDOJLSNSO-UHFFFAOYSA-N
XLogP3.28
TPSA62.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone?
The IUPAC name of (5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone (CID 745548) is (5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone is O=C(c1c(-c2ccccc2)oc2ccc(O)cc12)N1CCOCC1.
What is the InChIKey of (5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone?
The InChIKey is KYBZDPDOJLSNSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO4/c21-14-6-7-16-15(12-14)17(19(22)20-8-10-23-11-9-20)18(24-16)13-4-2-1-3-5-13/h1-7,12,21H,8-11H2.
What are the key properties of (5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone?
(5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone has a molecular weight of 323.35 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-hydroxy-2-phenyl-1-benzofuran-3-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 745548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).