N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide

C17H16Cl2N2O2 — CID 113001362

IUPACN-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
SMILESCc1ccccc1CC(=O)NCC(=O)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C17H16Cl2N2O2/c1-11-4-2-3-5-12(11)6-16(22)20-10-17(23)21-15-8-13(18)7-14(19)9-15/h2-5,7-9H,6,10H2,1H3,(H,20,22)(H,21,23)
InChIKeyVIGYAFBQJGVZJL-UHFFFAOYSA-N
MW351.23 g/mol
LogP3.60
Rot. Bonds5

About N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide

N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide (PubChem CID 113001362) has the molecular formula C17H16Cl2N2O2 and a molecular weight of 351.23 g/mol. Its IUPAC name is N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
PubChem CID113001362
Molecular FormulaC17H16Cl2N2O2
Molecular Weight351.23 g/mol
Exact Mass350.06
IUPAC NameN-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
SMILESCc1ccccc1CC(=O)NCC(=O)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C17H16Cl2N2O2/c1-11-4-2-3-5-12(11)6-16(22)20-10-17(23)21-15-8-13(18)7-14(19)9-15/h2-5,7-9H,6,10H2,1H3,(H,20,22)(H,21,23)
InChIKeyVIGYAFBQJGVZJL-UHFFFAOYSA-N
XLogP3.60
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.23
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-N-[2-(3,5-dichloroanilino)-2-oxoethyl]acetamide
CID 113001347
N-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 112998357
N-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 113000611
N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 112992693
N-[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 112998293
2-[(2-chlorophenyl)methylamino]-N-(3,5-dichlorophenyl)acetamide
CID 54832861
2-(2-bromophenyl)-N-[2-(3-chloro-4-methylanilino)-2-oxoethyl]acetamide
CID 112998185
N-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 113000084
N-[2-(3,5-dichloroanilino)-2-oxoethyl]-4-methylbenzamide
CID 46756068
N-[2-(2-tert-butylanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 112997518
N-(5-chloro-2-methylphenyl)-2-(2-methylphenyl)acetamide
CID 8624306
2-chloro-5-[[2-(2-methylphenyl)acetyl]amino]benzoic acid
CID 60748562

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide?
The IUPAC name of N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide (CID 113001362) is N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide.
What is the SMILES notation for N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide?
The canonical SMILES for N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide is Cc1ccccc1CC(=O)NCC(=O)Nc1cc(Cl)cc(Cl)c1.
What is the InChIKey of N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide?
The InChIKey is VIGYAFBQJGVZJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O2/c1-11-4-2-3-5-12(11)6-16(22)20-10-17(23)21-15-8-13(18)7-14(19)9-15/h2-5,7-9H,6,10H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide?
N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide has a molecular weight of 351.23 g/mol, XLogP of 3.60, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 113001362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).