N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide

C22H20ClNO2 — CID 155528719

IUPACN-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide
SMILESO=C(Cc1ccc(Oc2ccccc2)cc1)NCCc1ccc(Cl)cc1
InChIInChI=1S/C22H20ClNO2/c23-19-10-6-17(7-11-19)14-15-24-22(25)16-18-8-12-21(13-9-18)26-20-4-2-1-3-5-20/h1-13H,14-16H2,(H,24,25)
InChIKeyGQSMAKBFZOQFNG-UHFFFAOYSA-N
MW365.86 g/mol
LogP5.03
Rot. Bonds7

About N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide

N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide (PubChem CID 155528719) has the molecular formula C22H20ClNO2 and a molecular weight of 365.86 g/mol. Its IUPAC name is N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide
PubChem CID155528719
Molecular FormulaC22H20ClNO2
Molecular Weight365.86 g/mol
Exact Mass365.12
IUPAC NameN-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide
SMILESO=C(Cc1ccc(Oc2ccccc2)cc1)NCCc1ccc(Cl)cc1
InChIInChI=1S/C22H20ClNO2/c23-19-10-6-17(7-11-19)14-15-24-22(25)16-18-8-12-21(13-9-18)26-20-4-2-1-3-5-20/h1-13H,14-16H2,(H,24,25)
InChIKeyGQSMAKBFZOQFNG-UHFFFAOYSA-N
XLogP5.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.86
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide?
The IUPAC name of N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide (CID 155528719) is N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide.
What is the SMILES notation for N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide?
The canonical SMILES for N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide is O=C(Cc1ccc(Oc2ccccc2)cc1)NCCc1ccc(Cl)cc1.
What is the InChIKey of N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide?
The InChIKey is GQSMAKBFZOQFNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClNO2/c23-19-10-6-17(7-11-19)14-15-24-22(25)16-18-8-12-21(13-9-18)26-20-4-2-1-3-5-20/h1-13H,14-16H2,(H,24,25).
What are the key properties of N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide?
N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide has a molecular weight of 365.86 g/mol, XLogP of 5.03, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenyl)ethyl]-2-(4-phenoxyphenyl)acetamide is sourced from PubChem (CID 155528719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).