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

C19H19ClN2O3 — CID 25420567

IUPAC2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide
SMILESO=C(C[C@@H]1C(=O)OCCN1Cc1ccccc1)Nc1cccc(Cl)c1
InChIInChI=1S/C19H19ClN2O3/c20-15-7-4-8-16(11-15)21-18(23)12-17-19(24)25-10-9-22(17)13-14-5-2-1-3-6-14/h1-8,11,17H,9-10,12-13H2,(H,21,23)/t17-/m1/s1
InChIKeyNSHVXXAPIQADHQ-QGZVFWFLSA-N
MW358.83 g/mol
LogP3.10
Rot. Bonds5

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

2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide (PubChem CID 25420567) has the molecular formula C19H19ClN2O3 and a molecular weight of 358.83 g/mol. Its IUPAC name is 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide
PubChem CID25420567
Molecular FormulaC19H19ClN2O3
Molecular Weight358.83 g/mol
Exact Mass358.11
IUPAC Name2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide
SMILESO=C(C[C@@H]1C(=O)OCCN1Cc1ccccc1)Nc1cccc(Cl)c1
InChIInChI=1S/C19H19ClN2O3/c20-15-7-4-8-16(11-15)21-18(23)12-17-19(24)25-10-9-22(17)13-14-5-2-1-3-6-14/h1-8,11,17H,9-10,12-13H2,(H,21,23)/t17-/m1/s1
InChIKeyNSHVXXAPIQADHQ-QGZVFWFLSA-N
XLogP3.10
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.83
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide?
The IUPAC name of 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide (CID 25420567) is 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide.
What is the SMILES notation for 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide?
The canonical SMILES for 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide is O=C(C[C@@H]1C(=O)OCCN1Cc1ccccc1)Nc1cccc(Cl)c1.
What is the InChIKey of 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide?
The InChIKey is NSHVXXAPIQADHQ-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H19ClN2O3/c20-15-7-4-8-16(11-15)21-18(23)12-17-19(24)25-10-9-22(17)13-14-5-2-1-3-6-14/h1-8,11,17H,9-10,12-13H2,(H,21,23)/t17-/m1/s1.
What are the key properties of 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide?
2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide has a molecular weight of 358.83 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-4-benzyl-2-oxomorpholin-3-yl]-N-(3-chlorophenyl)acetamide is sourced from PubChem (CID 25420567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).