2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide

C17H18Cl2N2O — CID 26507373

IUPAC2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CNc1ccc(Cl)cc1Cl
InChIInChI=1S/C17H18Cl2N2O/c1-11(2)13-5-3-4-6-15(13)21-17(22)10-20-16-8-7-12(18)9-14(16)19/h3-9,11,20H,10H2,1-2H3,(H,21,22)
InChIKeyIFVFHVGWXRJODY-UHFFFAOYSA-N
MW337.25 g/mol
LogP5.17
Rot. Bonds5

About 2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide

2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 26507373) has the molecular formula C17H18Cl2N2O and a molecular weight of 337.25 g/mol. Its IUPAC name is 2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide
PubChem CID26507373
Molecular FormulaC17H18Cl2N2O
Molecular Weight337.25 g/mol
Exact Mass336.08
IUPAC Name2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CNc1ccc(Cl)cc1Cl
InChIInChI=1S/C17H18Cl2N2O/c1-11(2)13-5-3-4-6-15(13)21-17(22)10-20-16-8-7-12(18)9-14(16)19/h3-9,11,20H,10H2,1-2H3,(H,21,22)
InChIKeyIFVFHVGWXRJODY-UHFFFAOYSA-N
XLogP5.17
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.25
LogP ≤ 55.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide
CID 54811499
2-(2,5-dichlorophenyl)sulfanyl-N-(2-propan-2-ylphenyl)acetamide
CID 7870586
N-(3-chloro-4-fluorophenyl)-2-(2-propan-2-ylanilino)acetamide
CID 54823258
2-(4-chloro-2-methoxy-5-methylanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 109007861
N-(2-methylphenyl)-2-(2-propan-2-ylanilino)acetamide
CID 42069296
methyl 2-[[2-(2,4-dichloroanilino)-2-oxoethyl]amino]benzoate
CID 37472030
N-(2,4-dichlorophenyl)-2-[1-(2-fluorophenyl)ethylamino]acetamide
CID 18086055
2-(2,4-dimethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 37479068
2-(N-acetyl-2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 113179621
2,5-dichloro-N-(2-propan-2-ylphenyl)benzamide
CID 966223
2-(4-chlorophenyl)sulfanyl-N-(2-propan-2-ylphenyl)acetamide
CID 802169
2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide
CID 26506452

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide (CID 26507373) is 2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide is CC(C)c1ccccc1NC(=O)CNc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is IFVFHVGWXRJODY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O/c1-11(2)13-5-3-4-6-15(13)21-17(22)10-20-16-8-7-12(18)9-14(16)19/h3-9,11,20H,10H2,1-2H3,(H,21,22).
What are the key properties of 2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide?
2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 337.25 g/mol, XLogP of 5.17, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichloroanilino)-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 26507373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).