2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide

C18H19ClN2O2 — CID 113167376

IUPAC2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cccc(Cl)c1C)c1ccccc1C
InChIInChI=1S/C18H19ClN2O2/c1-12-7-4-5-10-17(12)21(14(3)22)11-18(23)20-16-9-6-8-15(19)13(16)2/h4-10H,11H2,1-3H3,(H,20,23)
InChIKeyHKJWVIPMCJUPLQ-UHFFFAOYSA-N
MW330.82 g/mol
LogP3.95
Rot. Bonds4

About 2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide

2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide (PubChem CID 113167376) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.82 g/mol. Its IUPAC name is 2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide
PubChem CID113167376
Molecular FormulaC18H19ClN2O2
Molecular Weight330.82 g/mol
Exact Mass330.11
IUPAC Name2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cccc(Cl)c1C)c1ccccc1C
InChIInChI=1S/C18H19ClN2O2/c1-12-7-4-5-10-17(12)21(14(3)22)11-18(23)20-16-9-6-8-15(19)13(16)2/h4-10H,11H2,1-3H3,(H,20,23)
InChIKeyHKJWVIPMCJUPLQ-UHFFFAOYSA-N
XLogP3.95
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(N-acetyl-3-chloro-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 113171767
2-(N-acetyl-2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide
CID 113171195
2-(N-acetyl-2-fluoroanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 113170822
2-(N-acetyl-2-ethoxyanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 113173786
2-(N-acetyl-2-methylanilino)-N-(2,5-dichlorophenyl)acetamide
CID 113167437
2-(N-acetyl-3,4-dimethylanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 113168353
2-(N-acetyl-4-chloro-2-methylanilino)-N-(2-methylphenyl)acetamide
CID 113172073
2-(N-acetyl-2-methylanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 113167364
2-(N-acetyl-2-bromoanilino)-N-(2-methylphenyl)acetamide
CID 113177819
2-(N-acetyl-3-bromoanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 113177953
2-(N-acetyl-3,4-dichloroanilino)-N-(2,3-dimethylphenyl)acetamide
CID 113179482
2-(N-acetyl-2-ethylanilino)-N-(2-methylphenyl)acetamide
CID 113169101

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide (CID 113167376) is 2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide is CC(=O)N(CC(=O)Nc1cccc(Cl)c1C)c1ccccc1C.
What is the InChIKey of 2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide?
The InChIKey is HKJWVIPMCJUPLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O2/c1-12-7-4-5-10-17(12)21(14(3)22)11-18(23)20-16-9-6-8-15(19)13(16)2/h4-10H,11H2,1-3H3,(H,20,23).
What are the key properties of 2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide?
2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide has a molecular weight of 330.82 g/mol, XLogP of 3.95, 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-(3-chloro-2-methylphenyl)acetamide is sourced from PubChem (CID 113167376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).