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

C16H15Cl2NO2 — CID 706860

IUPACN-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide
SMILESCCc1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C16H15Cl2NO2/c1-2-11-3-6-13(7-4-11)21-10-16(20)19-12-5-8-14(17)15(18)9-12/h3-9H,2,10H2,1H3,(H,19,20)
InChIKeyBHRPPYGKUNXVGB-UHFFFAOYSA-N
MW324.21 g/mol
LogP4.57
Rot. Bonds5

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

N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide (PubChem CID 706860) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide
PubChem CID706860
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC NameN-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide
SMILESCCc1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C16H15Cl2NO2/c1-2-11-3-6-13(7-4-11)21-10-16(20)19-12-5-8-14(17)15(18)9-12/h3-9H,2,10H2,1H3,(H,19,20)
InChIKeyBHRPPYGKUNXVGB-UHFFFAOYSA-N
XLogP4.57
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.21
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-acetamidophenoxy)-N-(3,4-dichlorophenyl)acetamide
CID 1296256
N-[4-chloro-3-[[2-(4-ethylphenoxy)acetyl]amino]phenyl]propanamide
CID 1313538
2-(4-chloro-3-methylphenoxy)-N-(4-ethylphenyl)acetamide
CID 841196
N-(3,4-dichlorophenyl)-2-[4-(2-ethoxyethoxy)phenoxy]acetamide
CID 4732949
N-(3,4-dichlorophenyl)-2-(4-phenoxyphenoxy)acetamide
CID 2319916
2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide
CID 39107615
N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide
CID 33152476
N-(4-ethylphenyl)-2-(4-fluorophenoxy)acetamide
CID 893586
N-(3,4-dichlorophenyl)-3-(4-ethoxyphenyl)propanamide
CID 19226004
N-[4-chloro-3-[5-(hydroxymethyl)furan-2-yl]phenyl]-2-(4-ethylphenoxy)acetamide
CID 28675834
2-[4-[[2-(4-ethylphenoxy)acetyl]amino]phenyl]-N-methylacetamide
CID 35364935
2-(4-acetamidophenoxy)-N-(3-ethylphenyl)acetamide
CID 7203355

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide?
The IUPAC name of N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide (CID 706860) is N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide is CCc1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1.
What is the InChIKey of N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide?
The InChIKey is BHRPPYGKUNXVGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-2-11-3-6-13(7-4-11)21-10-16(20)19-12-5-8-14(17)15(18)9-12/h3-9H,2,10H2,1H3,(H,19,20).
What are the key properties of N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide?
N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide has a molecular weight of 324.21 g/mol, XLogP of 4.57, 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-(4-ethylphenoxy)acetamide is sourced from PubChem (CID 706860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).