2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide

C15H12ClF2NO3 — CID 7858810

IUPAC2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide
SMILESO=C(COc1cccc(Cl)c1)Nc1ccc(OC(F)F)cc1
InChIInChI=1S/C15H12ClF2NO3/c16-10-2-1-3-13(8-10)21-9-14(20)19-11-4-6-12(7-5-11)22-15(17)18/h1-8,15H,9H2,(H,19,20)
InChIKeyQISGYWFBHPMYPE-UHFFFAOYSA-N
MW327.71 g/mol
LogP3.96
Rot. Bonds6

About 2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide

2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide (PubChem CID 7858810) has the molecular formula C15H12ClF2NO3 and a molecular weight of 327.71 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide
PubChem CID7858810
Molecular FormulaC15H12ClF2NO3
Molecular Weight327.71 g/mol
Exact Mass327.05
IUPAC Name2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide
SMILESO=C(COc1cccc(Cl)c1)Nc1ccc(OC(F)F)cc1
InChIInChI=1S/C15H12ClF2NO3/c16-10-2-1-3-13(8-10)21-9-14(20)19-11-4-6-12(7-5-11)22-15(17)18/h1-8,15H,9H2,(H,19,20)
InChIKeyQISGYWFBHPMYPE-UHFFFAOYSA-N
XLogP3.96
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.71
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(difluoromethoxy)phenyl]-2-(3-fluorophenoxy)acetamide
CID 2709478
N-[4-(difluoromethoxy)phenyl]-2-(3-methoxyphenoxy)acetamide
CID 2323436
N-[4-(difluoromethoxy)phenyl]-2-(3,5-dimethoxyphenoxy)acetamide
CID 7713910
[2-[4-(difluoromethoxy)anilino]-2-oxoethyl] 2-(3-bromophenoxy)acetate
CID 2388045
[2-[4-(difluoromethoxy)anilino]-2-oxoethyl] (E)-3-(3-chlorophenyl)prop-2-enoate
CID 2398251
N-(4-chlorophenyl)-2-(3-ethoxyphenoxy)acetamide
CID 112977797
[2-[4-(difluoromethoxy)anilino]-2-oxoethyl] 2-phenoxyacetate
CID 2506763
N-[4-(difluoromethoxy)phenyl]-2-(2-hydroxyphenoxy)acetamide
CID 78770173
4-[4-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]benzenesulfinate
CID 59334768
[2-[4-(difluoromethoxy)anilino]-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 8821313
2-(3-chlorophenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 2632951
N-[4-(difluoromethoxy)phenyl]-2-[3-[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenoxy]acetamide
CID 6991484

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide?
The IUPAC name of 2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide (CID 7858810) is 2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide?
The canonical SMILES for 2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide is O=C(COc1cccc(Cl)c1)Nc1ccc(OC(F)F)cc1.
What is the InChIKey of 2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide?
The InChIKey is QISGYWFBHPMYPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClF2NO3/c16-10-2-1-3-13(8-10)21-9-14(20)19-11-4-6-12(7-5-11)22-15(17)18/h1-8,15H,9H2,(H,19,20).
What are the key properties of 2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide?
2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide has a molecular weight of 327.71 g/mol, XLogP of 3.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-N-[4-(difluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 7858810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).