2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide

C25H24N2O4 — CID 41281603

IUPAC2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide
SMILESO=C(C[C@@H]1C(=O)OCCN1Cc1ccccc1)Nc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C25H24N2O4/c28-24(26-20-11-13-22(14-12-20)31-21-9-5-2-6-10-21)17-23-25(29)30-16-15-27(23)18-19-7-3-1-4-8-19/h1-14,23H,15-18H2,(H,26,28)/t23-/m1/s1
InChIKeyXVHJRIVNWBFMQW-HSZRJFAPSA-N
MW416.48 g/mol
LogP4.24
Rot. Bonds7

About 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide

2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide (PubChem CID 41281603) has the molecular formula C25H24N2O4 and a molecular weight of 416.48 g/mol. Its IUPAC name is 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide
PubChem CID41281603
Molecular FormulaC25H24N2O4
Molecular Weight416.48 g/mol
Exact Mass416.17
IUPAC Name2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide
SMILESO=C(C[C@@H]1C(=O)OCCN1Cc1ccccc1)Nc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C25H24N2O4/c28-24(26-20-11-13-22(14-12-20)31-21-9-5-2-6-10-21)17-23-25(29)30-16-15-27(23)18-19-7-3-1-4-8-19/h1-14,23H,15-18H2,(H,26,28)/t23-/m1/s1
InChIKeyXVHJRIVNWBFMQW-HSZRJFAPSA-N
XLogP4.24
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.48
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3S)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-nitrophenyl)acetamide
CID 40601796
2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3,4-dichlorophenyl)acetamide
CID 41475117
2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide
CID 25420567
dimethyl 5-[[2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]acetyl]amino]benzene-1,3-dicarboxylate
CID 41090664
2-[(3S)-4-benzyl-2-oxomorpholin-3-yl]-N-(2-fluorophenyl)acetamide
CID 41475064
2-[(3S)-4-benzyl-2-oxomorpholin-3-yl]-N-naphthalen-1-ylacetamide
CID 41281593
ethyl 4-[[2-[(3S)-4-ethyl-2-oxomorpholin-3-yl]acetyl]amino]benzoate
CID 40566787
(3S)-4-benzyl-3-phenylmorpholin-2-one
CID 15871960
(3R)-4-benzyl-3-phenylmorpholin-2-one
CID 12968270
2-(4-ethyl-2-oxomorpholin-3-yl)-N-(2-methylphenyl)acetamide
CID 44611957
3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide
CID 73259731
2-cyclohexyl-N-(4-phenoxyphenyl)acetamide
CID 806029

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide?
The IUPAC name of 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide (CID 41281603) is 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide.
What is the SMILES notation for 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide?
The canonical SMILES for 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide is O=C(C[C@@H]1C(=O)OCCN1Cc1ccccc1)Nc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide?
The InChIKey is XVHJRIVNWBFMQW-HSZRJFAPSA-N. The full InChI is InChI=1S/C25H24N2O4/c28-24(26-20-11-13-22(14-12-20)31-21-9-5-2-6-10-21)17-23-25(29)30-16-15-27(23)18-19-7-3-1-4-8-19/h1-14,23H,15-18H2,(H,26,28)/t23-/m1/s1.
What are the key properties of 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide?
2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide has a molecular weight of 416.48 g/mol, XLogP of 4.24, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(4-phenoxyphenyl)acetamide is sourced from PubChem (CID 41281603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).