N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide

C16H15Cl2NO2 — CID 879851

IUPACN-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2cc(Cl)cc(Cl)c2)cc1C
InChIInChI=1S/C16H15Cl2NO2/c1-10-3-4-15(5-11(10)2)21-9-16(20)19-14-7-12(17)6-13(18)8-14/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyXDAJFHXYXOOVCR-UHFFFAOYSA-N
MW324.21 g/mol
LogP4.63
Rot. Bonds4

About N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide

N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide (PubChem CID 879851) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide
PubChem CID879851
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC NameN-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2cc(Cl)cc(Cl)c2)cc1C
InChIInChI=1S/C16H15Cl2NO2/c1-10-3-4-15(5-11(10)2)21-9-16(20)19-14-7-12(17)6-13(18)8-14/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyXDAJFHXYXOOVCR-UHFFFAOYSA-N
XLogP4.63
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.21
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[[2-(3,4-dimethylphenoxy)acetyl]amino]phenoxy]acetate
CID 7316235
N-(4-chloro-2-methylphenyl)-2-(3,4-dimethylphenoxy)acetamide
CID 1122557
N-(3,5-dichlorophenyl)-2-[4-(3,5-dimethylphenoxy)phenoxy]acetamide
CID 18870439
N-(5-chloro-2-fluorophenyl)-2-(3,4-dimethylphenoxy)acetamide
CID 2554397
N-[3-[[2-(3,4-dimethylphenoxy)acetyl]amino]phenyl]propanamide
CID 17188267
2-(3,4-dimethylphenoxy)-N-(4-methylsulfanylphenyl)acetamide
CID 9153670
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,4-dimethylphenoxy)acetamide
CID 1321750
N-(3-chloro-4-cyanophenyl)-2-(3,4-dimethylphenoxy)acetamide
CID 2103781
methyl 2-[4-[2-(3,5-dichloroanilino)-2-oxoethoxy]phenyl]acetate
CID 7695186
N-(3,5-dichlorophenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 7467602
2-(3,4-dimethylphenoxy)-N-pyridin-1-ium-3-ylacetamide
CID 3658963
2-(3,4-dimethylphenoxy)-N-(4-nitrophenyl)acetamide
CID 4930992

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide?
The IUPAC name of N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide (CID 879851) is N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide is Cc1ccc(OCC(=O)Nc2cc(Cl)cc(Cl)c2)cc1C.
What is the InChIKey of N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide?
The InChIKey is XDAJFHXYXOOVCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-10-3-4-15(5-11(10)2)21-9-16(20)19-14-7-12(17)6-13(18)8-14/h3-8H,9H2,1-2H3,(H,19,20).
What are the key properties of N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide?
N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide has a molecular weight of 324.21 g/mol, XLogP of 4.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide is sourced from PubChem (CID 879851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).