[2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol

C19H19NO3 — CID 11255320

IUPAC[2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol
SMILESOCc1c(-c2ccc(N3CCOCC3)cc2)oc2ccccc12
InChIInChI=1S/C19H19NO3/c21-13-17-16-3-1-2-4-18(16)23-19(17)14-5-7-15(8-6-14)20-9-11-22-12-10-20/h1-8,21H,9-13H2
InChIKeyHEBQOBDFAYDRRP-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.43
Rot. Bonds3

About [2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol

[2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol (PubChem CID 11255320) has the molecular formula C19H19NO3 and a molecular weight of 309.37 g/mol. Its IUPAC name is [2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol.

Molecular Properties

Compound Name[2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol
PubChem CID11255320
Molecular FormulaC19H19NO3
Molecular Weight309.37 g/mol
Exact Mass309.14
IUPAC Name[2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol
SMILESOCc1c(-c2ccc(N3CCOCC3)cc2)oc2ccccc12
InChIInChI=1S/C19H19NO3/c21-13-17-16-3-1-2-4-18(16)23-19(17)14-5-7-15(8-6-14)20-9-11-22-12-10-20/h1-8,21H,9-13H2
InChIKeyHEBQOBDFAYDRRP-UHFFFAOYSA-N
XLogP3.43
TPSA45.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol?
The IUPAC name of [2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol (CID 11255320) is [2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol.
What is the SMILES notation for [2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol?
The canonical SMILES for [2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol is OCc1c(-c2ccc(N3CCOCC3)cc2)oc2ccccc12.
What is the InChIKey of [2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol?
The InChIKey is HEBQOBDFAYDRRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO3/c21-13-17-16-3-1-2-4-18(16)23-19(17)14-5-7-15(8-6-14)20-9-11-22-12-10-20/h1-8,21H,9-13H2.
What are the key properties of [2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol?
[2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol has a molecular weight of 309.37 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-morpholin-4-ylphenyl)-1-benzofuran-3-yl]methanol is sourced from PubChem (CID 11255320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).