N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide

C20H15ClFNO2 — CID 57394715

IUPACN-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide
SMILESO=C(Cc1cccc(Oc2ccc(F)cc2)c1)Nc1cccc(Cl)c1
InChIInChI=1S/C20H15ClFNO2/c21-15-4-2-5-17(13-15)23-20(24)12-14-3-1-6-19(11-14)25-18-9-7-16(22)8-10-18/h1-11,13H,12H2,(H,23,24)
InChIKeyZYOYPVAEQAPJBT-UHFFFAOYSA-N
MW355.80 g/mol
LogP5.45
Rot. Bonds5

About N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide

N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide (PubChem CID 57394715) has the molecular formula C20H15ClFNO2 and a molecular weight of 355.80 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide
PubChem CID57394715
Molecular FormulaC20H15ClFNO2
Molecular Weight355.80 g/mol
Exact Mass355.08
IUPAC NameN-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide
SMILESO=C(Cc1cccc(Oc2ccc(F)cc2)c1)Nc1cccc(Cl)c1
InChIInChI=1S/C20H15ClFNO2/c21-15-4-2-5-17(13-15)23-20(24)12-14-3-1-6-19(11-14)25-18-9-7-16(22)8-10-18/h1-11,13H,12H2,(H,23,24)
InChIKeyZYOYPVAEQAPJBT-UHFFFAOYSA-N
XLogP5.45
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.80
LogP ≤ 55.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide (CID 57394715) is N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide is O=C(Cc1cccc(Oc2ccc(F)cc2)c1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide?
The InChIKey is ZYOYPVAEQAPJBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClFNO2/c21-15-4-2-5-17(13-15)23-20(24)12-14-3-1-6-19(11-14)25-18-9-7-16(22)8-10-18/h1-11,13H,12H2,(H,23,24).
What are the key properties of N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide?
N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide has a molecular weight of 355.80 g/mol, XLogP of 5.45, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-[3-(4-fluorophenoxy)phenyl]acetamide is sourced from PubChem (CID 57394715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).