N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide

C22H28N2O4 — CID 112503607

IUPACN-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide
SMILESCCOc1ccc(C(CNC(=O)COc2ccccc2)N2CCOCC2)cc1
InChIInChI=1S/C22H28N2O4/c1-2-27-20-10-8-18(9-11-20)21(24-12-14-26-15-13-24)16-23-22(25)17-28-19-6-4-3-5-7-19/h3-11,21H,2,12-17H2,1H3,(H,23,25)
InChIKeyRBRRPEYGVNCBIN-UHFFFAOYSA-N
MW384.48 g/mol
LogP2.65
Rot. Bonds9

About N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide

N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide (PubChem CID 112503607) has the molecular formula C22H28N2O4 and a molecular weight of 384.48 g/mol. Its IUPAC name is N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide
PubChem CID112503607
Molecular FormulaC22H28N2O4
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC NameN-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide
SMILESCCOc1ccc(C(CNC(=O)COc2ccccc2)N2CCOCC2)cc1
InChIInChI=1S/C22H28N2O4/c1-2-27-20-10-8-18(9-11-20)21(24-12-14-26-15-13-24)16-23-22(25)17-28-19-6-4-3-5-7-19/h3-11,21H,2,12-17H2,1H3,(H,23,25)
InChIKeyRBRRPEYGVNCBIN-UHFFFAOYSA-N
XLogP2.65
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide?
The IUPAC name of N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide (CID 112503607) is N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide?
The canonical SMILES for N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide is CCOc1ccc(C(CNC(=O)COc2ccccc2)N2CCOCC2)cc1.
What is the InChIKey of N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide?
The InChIKey is RBRRPEYGVNCBIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4/c1-2-27-20-10-8-18(9-11-20)21(24-12-14-26-15-13-24)16-23-22(25)17-28-19-6-4-3-5-7-19/h3-11,21H,2,12-17H2,1H3,(H,23,25).
What are the key properties of N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide?
N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide has a molecular weight of 384.48 g/mol, XLogP of 2.65, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide is sourced from PubChem (CID 112503607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).