2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide

C23H21NO4 — CID 92761558

IUPAC2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide
SMILESO=C(COc1ccccc1)NC[C@H]1Cc2cc(Oc3ccccc3)ccc2O1
InChIInChI=1S/C23H21NO4/c25-23(16-26-18-7-3-1-4-8-18)24-15-21-14-17-13-20(11-12-22(17)28-21)27-19-9-5-2-6-10-19/h1-13,21H,14-16H2,(H,24,25)/t21-/m1/s1
InChIKeyLFDGLEILCCRGDB-OAQYLSRUSA-N
MW375.42 g/mol
LogP3.98
Rot. Bonds7

About 2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide

2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide (PubChem CID 92761558) has the molecular formula C23H21NO4 and a molecular weight of 375.42 g/mol. Its IUPAC name is 2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide.

Molecular Properties

Compound Name2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide
PubChem CID92761558
Molecular FormulaC23H21NO4
Molecular Weight375.42 g/mol
Exact Mass375.15
IUPAC Name2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide
SMILESO=C(COc1ccccc1)NC[C@H]1Cc2cc(Oc3ccccc3)ccc2O1
InChIInChI=1S/C23H21NO4/c25-23(16-26-18-7-3-1-4-8-18)24-15-21-14-17-13-20(11-12-22(17)28-21)27-19-9-5-2-6-10-19/h1-13,21H,14-16H2,(H,24,25)/t21-/m1/s1
InChIKeyLFDGLEILCCRGDB-OAQYLSRUSA-N
XLogP3.98
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.42
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide with MolForge

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Related Compounds

N-[[(2S)-5-methoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-phenoxyacetamide
CID 92757032
N-[[(2S)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]prop-2-enamide
CID 92757118
2-methyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide
CID 46090158
4-fluoro-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide
CID 46082466
3,4-dimethoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]benzamide
CID 92767700
(2R)-2-ethyl-N-[[(2S)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]hexanamide
CID 92758001
2-ethyl-N-[(5-phenoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]hexanamide
CID 46090185
2-(4-methylphenoxy)-N-[[(2S)-5-(4-methylsulfonylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide
CID 42272579
3-[2-[[(2S)-2,3-dihydro-1-benzofuran-2-yl]methylamino]-2-oxoethoxy]benzamide
CID 94648224
N-[[(3S)-3,4-dihydro-1H-isochromen-3-yl]methyl]-2-phenoxyacetamide
CID 100750973
N-(3,4-dihydro-1H-isochromen-3-ylmethyl)-2-phenoxyacetamide
CID 91626502
N-[[(3R)-3,4-dihydro-1H-isochromen-3-yl]methyl]-2-phenoxyacetamide
CID 100750967

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide?
The IUPAC name of 2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide (CID 92761558) is 2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide.
What is the SMILES notation for 2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide?
The canonical SMILES for 2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide is O=C(COc1ccccc1)NC[C@H]1Cc2cc(Oc3ccccc3)ccc2O1.
What is the InChIKey of 2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide?
The InChIKey is LFDGLEILCCRGDB-OAQYLSRUSA-N. The full InChI is InChI=1S/C23H21NO4/c25-23(16-26-18-7-3-1-4-8-18)24-15-21-14-17-13-20(11-12-22(17)28-21)27-19-9-5-2-6-10-19/h1-13,21H,14-16H2,(H,24,25)/t21-/m1/s1.
What are the key properties of 2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide?
2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide has a molecular weight of 375.42 g/mol, XLogP of 3.98, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-[[(2R)-5-phenoxy-2,3-dihydro-1-benzofuran-2-yl]methyl]acetamide is sourced from PubChem (CID 92761558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).