2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide

C17H18Cl2N2O — CID 42069816

IUPAC2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide
SMILESCc1cc(C)c(NC(=O)CNc2cccc(Cl)c2Cl)c(C)c1
InChIInChI=1S/C17H18Cl2N2O/c1-10-7-11(2)17(12(3)8-10)21-15(22)9-20-14-6-4-5-13(18)16(14)19/h4-8,20H,9H2,1-3H3,(H,21,22)
InChIKeyFJIBOMJGUVVYPI-UHFFFAOYSA-N
MW337.25 g/mol
LogP4.97
Rot. Bonds4

About 2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide

2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide (PubChem CID 42069816) has the molecular formula C17H18Cl2N2O and a molecular weight of 337.25 g/mol. Its IUPAC name is 2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide
PubChem CID42069816
Molecular FormulaC17H18Cl2N2O
Molecular Weight337.25 g/mol
Exact Mass336.08
IUPAC Name2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide
SMILESCc1cc(C)c(NC(=O)CNc2cccc(Cl)c2Cl)c(C)c1
InChIInChI=1S/C17H18Cl2N2O/c1-10-7-11(2)17(12(3)8-10)21-15(22)9-20-14-6-4-5-13(18)16(14)19/h4-8,20H,9H2,1-3H3,(H,21,22)
InChIKeyFJIBOMJGUVVYPI-UHFFFAOYSA-N
XLogP4.97
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.25
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dichlorophenyl)-2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]acetamide
CID 9339279
2-(2,3-dichloroanilino)-N-(2-ethyl-6-methylphenyl)acetamide
CID 54815902
N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide
CID 33162844
N-(4-acetamidophenyl)-2-(2,3-dichloroanilino)acetamide
CID 54816111
N-(3-acetylphenyl)-2-(2,3-dichloroanilino)acetamide
CID 42069766
N-(4-chlorophenyl)-2-(2,3-dichloroanilino)acetamide
CID 29039257
N-(2-chloro-4,6-dimethylphenyl)-2-(2,6-difluoroanilino)acetamide
CID 109008818
2-(2,5-dimethylanilino)-N-(2,4,6-trimethylphenyl)acetamide
CID 26415868
N-(3-chloro-4-fluorophenyl)-2-(2,3-dichloroanilino)acetamide
CID 54815845
2-(2-piperidin-1-ylanilino)-N-(2,4,6-trimethylphenyl)acetamide
CID 9100126
N-[3-[[2-(2,3-dichloroanilino)acetyl]amino]-2-methylphenyl]cyclopropanecarboxamide
CID 54815961
2-(2-chloro-4,6-dimethylanilino)-N-(2-fluorophenyl)acetamide
CID 42125159

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide?
The IUPAC name of 2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide (CID 42069816) is 2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide.
What is the SMILES notation for 2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide?
The canonical SMILES for 2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide is Cc1cc(C)c(NC(=O)CNc2cccc(Cl)c2Cl)c(C)c1.
What is the InChIKey of 2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide?
The InChIKey is FJIBOMJGUVVYPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O/c1-10-7-11(2)17(12(3)8-10)21-15(22)9-20-14-6-4-5-13(18)16(14)19/h4-8,20H,9H2,1-3H3,(H,21,22).
What are the key properties of 2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide?
2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide has a molecular weight of 337.25 g/mol, XLogP of 4.97, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide is sourced from PubChem (CID 42069816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).