2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide

C20H24ClN3O3 — CID 124992315

About 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide

2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide (PubChem CID 124992315) has the molecular formula C20H24ClN3O3 and a molecular weight of 389.88 g/mol. Its IUPAC name is 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide.

Molecular Properties

• Compound Name: 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide
• PubChem CID: 124992315
• Molecular Formula: C20H24ClN3O3
• Molecular Weight: 389.88 g/mol
• Exact Mass: 389.15
• IUPAC Name: 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide
• SMILES: Cc1cncc(CN2CCO[C@](COc3cccc(Cl)c3)(CC(N)=O)C2)c1
• InChI: InChI=1S/C20H24ClN3O3/c1-15-7-16(11-23-10-15)12-24-5-6-27-20(13-24,9-19(22)25)14-26-18-4-2-3-17(21)8-18/h2-4,7-8,10-11H,5-6,9,12-14H2,1H3,(H2,22,25)/t20-/m1/s1
• InChIKey: PPPJSAQYZLHZFS-HXUWFJFHSA-N
• XLogP: 2.57
• TPSA: 77.68 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	389.88
LogP ≤ 5	2.57
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide?

The IUPAC name of 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide (CID 124992315) is 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide.

What is the SMILES notation for 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide?

The canonical SMILES for 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide is Cc1cncc(CN2CCO[C@](COc3cccc(Cl)c3)(CC(N)=O)C2)c1.

What is the InChIKey of 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide?

The InChIKey is PPPJSAQYZLHZFS-HXUWFJFHSA-N. The full InChI is InChI=1S/C20H24ClN3O3/c1-15-7-16(11-23-10-15)12-24-5-6-27-20(13-24,9-19(22)25)14-26-18-4-2-3-17(21)8-18/h2-4,7-8,10-11H,5-6,9,12-14H2,1H3,(H2,22,25)/t20-/m1/s1.

What are the key properties of 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide?

2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide has a molecular weight of 389.88 g/mol, XLogP of 2.57, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(2R)-2-[(3-chlorophenoxy)methyl]-4-[(5-methyl-3-pyridinyl)methyl]morpholin-2-yl]acetamide is sourced from PubChem (CID 124992315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).