4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide

C23H22N2O4 — CID 26243690

IUPAC4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide
SMILESCCOc1ccc(Oc2ccccc2NC(=O)c2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C23H22N2O4/c1-3-28-19-12-14-20(15-13-19)29-22-7-5-4-6-21(22)25-23(27)17-8-10-18(11-9-17)24-16(2)26/h4-15H,3H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyFFGGWEYRKIUIHM-UHFFFAOYSA-N
MW390.44 g/mol
LogP5.09
Rot. Bonds7

About 4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide

4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide (PubChem CID 26243690) has the molecular formula C23H22N2O4 and a molecular weight of 390.44 g/mol. Its IUPAC name is 4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide.

Molecular Properties

Compound Name4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide
PubChem CID26243690
Molecular FormulaC23H22N2O4
Molecular Weight390.44 g/mol
Exact Mass390.16
IUPAC Name4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide
SMILESCCOc1ccc(Oc2ccccc2NC(=O)c2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C23H22N2O4/c1-3-28-19-12-14-20(15-13-19)29-22-7-5-4-6-21(22)25-23(27)17-8-10-18(11-9-17)24-16(2)26/h4-15H,3H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyFFGGWEYRKIUIHM-UHFFFAOYSA-N
XLogP5.09
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.44
LogP ≤ 55.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide?
The IUPAC name of 4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide (CID 26243690) is 4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide.
What is the SMILES notation for 4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide?
The canonical SMILES for 4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide is CCOc1ccc(Oc2ccccc2NC(=O)c2ccc(NC(C)=O)cc2)cc1.
What is the InChIKey of 4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide?
The InChIKey is FFGGWEYRKIUIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O4/c1-3-28-19-12-14-20(15-13-19)29-22-7-5-4-6-21(22)25-23(27)17-8-10-18(11-9-17)24-16(2)26/h4-15H,3H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of 4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide?
4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide has a molecular weight of 390.44 g/mol, XLogP of 5.09, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide is sourced from PubChem (CID 26243690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).