N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide

C22H21NO4 — CID 78838328

IUPACN-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide
SMILESCCOc1ccc(Oc2ccccc2NC(=O)Cc2ccc(O)cc2)cc1
InChIInChI=1S/C22H21NO4/c1-2-26-18-11-13-19(14-12-18)27-21-6-4-3-5-20(21)23-22(25)15-16-7-9-17(24)10-8-16/h3-14,24H,2,15H2,1H3,(H,23,25)
InChIKeyRKSJEWRFUQKRPQ-UHFFFAOYSA-N
MW363.41 g/mol
LogP4.76
Rot. Bonds7

About N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide

N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide (PubChem CID 78838328) has the molecular formula C22H21NO4 and a molecular weight of 363.41 g/mol. Its IUPAC name is N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide
PubChem CID78838328
Molecular FormulaC22H21NO4
Molecular Weight363.41 g/mol
Exact Mass363.15
IUPAC NameN-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide
SMILESCCOc1ccc(Oc2ccccc2NC(=O)Cc2ccc(O)cc2)cc1
InChIInChI=1S/C22H21NO4/c1-2-26-18-11-13-19(14-12-18)27-21-6-4-3-5-20(21)23-22(25)15-16-7-9-17(24)10-8-16/h3-14,24H,2,15H2,1H3,(H,23,25)
InChIKeyRKSJEWRFUQKRPQ-UHFFFAOYSA-N
XLogP4.76
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.41
LogP ≤ 54.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide?
The IUPAC name of N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide (CID 78838328) is N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide.
What is the SMILES notation for N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide?
The canonical SMILES for N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide is CCOc1ccc(Oc2ccccc2NC(=O)Cc2ccc(O)cc2)cc1.
What is the InChIKey of N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide?
The InChIKey is RKSJEWRFUQKRPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO4/c1-2-26-18-11-13-19(14-12-18)27-21-6-4-3-5-20(21)23-22(25)15-16-7-9-17(24)10-8-16/h3-14,24H,2,15H2,1H3,(H,23,25).
What are the key properties of N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide?
N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide has a molecular weight of 363.41 g/mol, XLogP of 4.76, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide is sourced from PubChem (CID 78838328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).