2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide

C18H18Cl2N2O3 — CID 113180044

IUPAC2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)CN(C(C)=O)c2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C18H18Cl2N2O3/c1-3-25-14-9-7-13(8-10-14)21-17(24)11-22(12(2)23)18-15(19)5-4-6-16(18)20/h4-10H,3,11H2,1-2H3,(H,21,24)
InChIKeyXMJMGCJSPDGFSE-UHFFFAOYSA-N
MW381.26 g/mol
LogP4.38
Rot. Bonds6

About 2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide

2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide (PubChem CID 113180044) has the molecular formula C18H18Cl2N2O3 and a molecular weight of 381.26 g/mol. Its IUPAC name is 2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide
PubChem CID113180044
Molecular FormulaC18H18Cl2N2O3
Molecular Weight381.26 g/mol
Exact Mass380.07
IUPAC Name2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)CN(C(C)=O)c2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C18H18Cl2N2O3/c1-3-25-14-9-7-13(8-10-14)21-17(24)11-22(12(2)23)18-15(19)5-4-6-16(18)20/h4-10H,3,11H2,1-2H3,(H,21,24)
InChIKeyXMJMGCJSPDGFSE-UHFFFAOYSA-N
XLogP4.38
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.26
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide
CID 113179508
2-(N-acetyl-4-ethoxyanilino)-N-(2,6-dichlorophenyl)acetamide
CID 113174005
2-(4-acetamido-N-acetylanilino)-N-(4-ethoxyphenyl)acetamide
CID 113175991
2-(N-acetyl-2,6-dichloroanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 113180038
2-[N-acetyl-4-(trifluoromethyl)anilino]-N-(4-ethoxyphenyl)acetamide
CID 113175341
2-(N-acetyl-2-cyanoanilino)-N-(4-ethoxyphenyl)acetamide
CID 113180757
3-(2,6-dichloroanilino)-N-(4-ethoxyphenyl)propanamide
CID 109039909
2-(N-acetyl-2,6-diethylanilino)-N-(4-chlorophenyl)acetamide
CID 113170186
2-[[2-(4-chloroanilino)-2-oxoethyl]-methylamino]-N-(4-ethoxyphenyl)acetamide
CID 9167171
2-(N-acetyl-2,6-dimethylanilino)-N-(4-methoxyphenyl)acetamide
CID 113168753
2-(N-acetyl-4-ethoxyanilino)-N-(3,4-dimethylphenyl)acetamide
CID 113173936
2-(N-acetyl-2,3-dichloroanilino)-N-(4-chlorophenyl)acetamide
CID 113180167

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide (CID 113180044) is 2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide is CCOc1ccc(NC(=O)CN(C(C)=O)c2c(Cl)cccc2Cl)cc1.
What is the InChIKey of 2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide?
The InChIKey is XMJMGCJSPDGFSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O3/c1-3-25-14-9-7-13(8-10-14)21-17(24)11-22(12(2)23)18-15(19)5-4-6-16(18)20/h4-10H,3,11H2,1-2H3,(H,21,24).
What are the key properties of 2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide?
2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide has a molecular weight of 381.26 g/mol, XLogP of 4.38, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide is sourced from PubChem (CID 113180044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).