N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide

C20H15Cl2NO2 — CID 56951685

IUPACN-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide
SMILESO=C(Cc1cccc(Oc2ccccc2)c1)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C20H15Cl2NO2/c21-18-10-9-15(13-19(18)22)23-20(24)12-14-5-4-8-17(11-14)25-16-6-2-1-3-7-16/h1-11,13H,12H2,(H,23,24)
InChIKeyAHUGPHKJFGGARD-UHFFFAOYSA-N
MW372.25 g/mol
LogP5.97
Rot. Bonds5

About N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide

N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide (PubChem CID 56951685) has the molecular formula C20H15Cl2NO2 and a molecular weight of 372.25 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide
PubChem CID56951685
Molecular FormulaC20H15Cl2NO2
Molecular Weight372.25 g/mol
Exact Mass371.05
IUPAC NameN-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide
SMILESO=C(Cc1cccc(Oc2ccccc2)c1)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C20H15Cl2NO2/c21-18-10-9-15(13-19(18)22)23-20(24)12-14-5-4-8-17(11-14)25-16-6-2-1-3-7-16/h1-11,13H,12H2,(H,23,24)
InChIKeyAHUGPHKJFGGARD-UHFFFAOYSA-N
XLogP5.97
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.25
LogP ≤ 55.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide?
The IUPAC name of N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide (CID 56951685) is N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide is O=C(Cc1cccc(Oc2ccccc2)c1)Nc1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide?
The InChIKey is AHUGPHKJFGGARD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2NO2/c21-18-10-9-15(13-19(18)22)23-20(24)12-14-5-4-8-17(11-14)25-16-6-2-1-3-7-16/h1-11,13H,12H2,(H,23,24).
What are the key properties of N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide?
N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide has a molecular weight of 372.25 g/mol, XLogP of 5.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-2-(3-phenoxyphenyl)acetamide is sourced from PubChem (CID 56951685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).