N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide

C22H20ClNO4 — CID 4783296

IUPACN-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)COc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C22H20ClNO4/c1-26-21-12-7-17(23)13-20(21)24-22(25)15-28-19-10-8-18(9-11-19)27-14-16-5-3-2-4-6-16/h2-13H,14-15H2,1H3,(H,24,25)
InChIKeyABHGWWWFBQGFCN-UHFFFAOYSA-N
MW397.86 g/mol
LogP4.95
Rot. Bonds8

About N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide

N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide (PubChem CID 4783296) has the molecular formula C22H20ClNO4 and a molecular weight of 397.86 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide
PubChem CID4783296
Molecular FormulaC22H20ClNO4
Molecular Weight397.86 g/mol
Exact Mass397.11
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)COc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C22H20ClNO4/c1-26-21-12-7-17(23)13-20(21)24-22(25)15-28-19-10-8-18(9-11-19)27-14-16-5-3-2-4-6-16/h2-13H,14-15H2,1H3,(H,24,25)
InChIKeyABHGWWWFBQGFCN-UHFFFAOYSA-N
XLogP4.95
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.86
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-2-(4-phenylphenoxy)acetamide
CID 1193872
2-[4-[benzyl(methyl)sulfamoyl]phenoxy]-N-(5-chloro-2-methoxyphenyl)acetamide
CID 4531228
N-(5-chloro-2-methoxyphenyl)-2-(4-cyanophenoxy)acetamide
CID 7503472
N-(5-chloro-2-methoxyphenyl)-2-(2-chlorophenoxy)acetamide
CID 870474
N-(5-chloro-2-methoxyphenyl)-2-(4-octoxyphenoxy)acetamide
CID 4733029
N-(5-chloro-2-methoxyphenyl)-2-(2-fluorophenoxy)acetamide
CID 2326605
2-(3-butoxyphenoxy)-N-(5-chloro-2-methoxyphenyl)acetamide
CID 4733171
1-(5-chloro-2-methoxyphenyl)-3-[[2-(4-ethylphenoxy)acetyl]amino]urea
CID 4055904
N-(5-chloro-2-methoxyphenyl)-2-(3-fluorophenoxy)acetamide
CID 2710232
N-(5-chloro-2-methoxyphenyl)-2-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenoxy]acetamide
CID 126149238
N-(3,5-dichlorophenyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 7926056
N'-[(Z)-[4-(2-anilino-2-oxoethoxy)phenyl]methylideneamino]-N-(5-chloro-2-methoxyphenyl)oxamide
CID 94832882

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide (CID 4783296) is N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide is COc1ccc(Cl)cc1NC(=O)COc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide?
The InChIKey is ABHGWWWFBQGFCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClNO4/c1-26-21-12-7-17(23)13-20(21)24-22(25)15-28-19-10-8-18(9-11-19)27-14-16-5-3-2-4-6-16/h2-13H,14-15H2,1H3,(H,24,25).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide?
N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide has a molecular weight of 397.86 g/mol, XLogP of 4.95, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide is sourced from PubChem (CID 4783296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).