2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide

C17H16Cl2N2O2 — CID 113167437

IUPAC2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1C
InChIInChI=1S/C17H16Cl2N2O2/c1-11-5-3-4-6-16(11)21(12(2)22)10-17(23)20-15-9-13(18)7-8-14(15)19/h3-9H,10H2,1-2H3,(H,20,23)
InChIKeyPQNTWDOGOLNIQW-UHFFFAOYSA-N
MW351.23 g/mol
LogP4.29
Rot. Bonds4

About 2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide

2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide (PubChem CID 113167437) has the molecular formula C17H16Cl2N2O2 and a molecular weight of 351.23 g/mol. Its IUPAC name is 2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide
PubChem CID113167437
Molecular FormulaC17H16Cl2N2O2
Molecular Weight351.23 g/mol
Exact Mass350.06
IUPAC Name2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1C
InChIInChI=1S/C17H16Cl2N2O2/c1-11-5-3-4-6-16(11)21(12(2)22)10-17(23)20-15-9-13(18)7-8-14(15)19/h3-9H,10H2,1-2H3,(H,20,23)
InChIKeyPQNTWDOGOLNIQW-UHFFFAOYSA-N
XLogP4.29
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.23
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-4-chloro-2-methylanilino)-N-(2-methylphenyl)acetamide
CID 113172073
2-(N-acetyl-2-fluoroanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 113170823
2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 113167376
2-(N-acetyl-4-chloro-2-methylanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 113172103
2-(N-acetyl-2-chloro-4,6-dimethylanilino)-N-(2,5-dichlorophenyl)acetamide
CID 113172625
2-(N-acetyl-2,3,4-trifluoroanilino)-N-(2,5-dichlorophenyl)acetamide
CID 113181358
2-(N-acetyl-2-methylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113167429
2-(N-acetyl-2,3-dimethylanilino)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
CID 113168967
2-(N-acetyl-2,5-dimethylanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 113168161
2-(N-acetyl-2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide
CID 113171195
2-(N-acetyl-3-fluoroanilino)-N-(2,5-dichlorophenyl)acetamide
CID 113177743
2-[N-acetyl-2-(trifluoromethyl)anilino]-N-(4-chloro-2-methylphenyl)acetamide
CID 113175063

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide (CID 113167437) is 2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide is CC(=O)N(CC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1C.
What is the InChIKey of 2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide?
The InChIKey is PQNTWDOGOLNIQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O2/c1-11-5-3-4-6-16(11)21(12(2)22)10-17(23)20-15-9-13(18)7-8-14(15)19/h3-9H,10H2,1-2H3,(H,20,23).
What are the key properties of 2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide?
2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide has a molecular weight of 351.23 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide is sourced from PubChem (CID 113167437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).