N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide

C18H20N2O3 — CID 675127

IUPACN-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C18H20N2O3/c21-18(14-23-17-4-2-1-3-5-17)19-15-6-8-16(9-7-15)20-10-12-22-13-11-20/h1-9H,10-14H2,(H,19,21)
InChIKeyZQQOWEMMFOAYAQ-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.54
Rot. Bonds5

About N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide

N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide (PubChem CID 675127) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide
PubChem CID675127
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C18H20N2O3/c21-18(14-23-17-4-2-1-3-5-17)19-15-6-8-16(9-7-15)20-10-12-22-13-11-20/h1-9H,10-14H2,(H,19,21)
InChIKeyZQQOWEMMFOAYAQ-UHFFFAOYSA-N
XLogP2.54
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide?
The IUPAC name of N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide (CID 675127) is N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide.
What is the SMILES notation for N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide?
The canonical SMILES for N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide is O=C(COc1ccccc1)Nc1ccc(N2CCOCC2)cc1.
What is the InChIKey of N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide?
The InChIKey is ZQQOWEMMFOAYAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c21-18(14-23-17-4-2-1-3-5-17)19-15-6-8-16(9-7-15)20-10-12-22-13-11-20/h1-9H,10-14H2,(H,19,21).
What are the key properties of N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide?
N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide has a molecular weight of 312.37 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide is sourced from PubChem (CID 675127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).