2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide

C18H18Cl2N2O3 — CID 113179508

IUPAC2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)CN(C(C)=O)c2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C18H18Cl2N2O3/c1-3-25-15-7-4-13(5-8-15)21-18(24)11-22(12(2)23)14-6-9-16(19)17(20)10-14/h4-10H,3,11H2,1-2H3,(H,21,24)
InChIKeyLVNZGILOJYQCBO-UHFFFAOYSA-N
MW381.26 g/mol
LogP4.38
Rot. Bonds6

About 2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide

2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide (PubChem CID 113179508) has the molecular formula C18H18Cl2N2O3 and a molecular weight of 381.26 g/mol. Its IUPAC name is 2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide
PubChem CID113179508
Molecular FormulaC18H18Cl2N2O3
Molecular Weight381.26 g/mol
Exact Mass380.07
IUPAC Name2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)CN(C(C)=O)c2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C18H18Cl2N2O3/c1-3-25-15-7-4-13(5-8-15)21-18(24)11-22(12(2)23)14-6-9-16(19)17(20)10-14/h4-10H,3,11H2,1-2H3,(H,21,24)
InChIKeyLVNZGILOJYQCBO-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-(4-acetamido-N-acetylanilino)-N-(4-ethoxyphenyl)acetamide
CID 113175991
2-(N-acetyl-3,4-dichloroanilino)-N-phenylacetamide
CID 113179470
2-(N-acetyl-2,6-dichloroanilino)-N-(4-ethoxyphenyl)acetamide
CID 113180044
2-(N-acetyl-4-ethoxyanilino)-N-(3,4-dimethylphenyl)acetamide
CID 113173936
2-[N-acetyl-4-(trifluoromethyl)anilino]-N-(4-ethoxyphenyl)acetamide
CID 113175341
2-(N-acetyl-4-ethoxyanilino)-N-(2,6-dichlorophenyl)acetamide
CID 113174005
2-(N-acetyl-3-chloro-4-fluoroanilino)-N-(4-methoxyphenyl)acetamide
CID 113172443
2-[N-acetyl-4-(diethylamino)-2-methylanilino]-N-(4-ethoxyphenyl)acetamide
CID 113180480
2-(N-acetyl-4-ethoxyanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 113174007
2-(N-acetyl-3-chloro-4-methylanilino)-N-(4-fluorophenyl)acetamide
CID 113172264
2-(4-acetamido-N-acetylanilino)-N-(3,5-dichlorophenyl)acetamide
CID 113176021
methyl 4-[[2-(N-acetyl-3-chloro-4-methylanilino)acetyl]amino]benzoate
CID 113172297

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide (CID 113179508) is 2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide is CCOc1ccc(NC(=O)CN(C(C)=O)c2ccc(Cl)c(Cl)c2)cc1.
What is the InChIKey of 2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide?
The InChIKey is LVNZGILOJYQCBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O3/c1-3-25-15-7-4-13(5-8-15)21-18(24)11-22(12(2)23)14-6-9-16(19)17(20)10-14/h4-10H,3,11H2,1-2H3,(H,21,24).
What are the key properties of 2-(N-acetyl-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide?
2-(N-acetyl-3,4-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-3,4-dichloroanilino)-N-(4-ethoxyphenyl)acetamide is sourced from PubChem (CID 113179508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).