2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide

C17H19ClN2O3 — CID 26507119

IUPAC2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)CNc2ccc(Cl)cc2C)cc(OC)c1
InChIInChI=1S/C17H19ClN2O3/c1-11-6-12(18)4-5-16(11)19-10-17(21)20-13-7-14(22-2)9-15(8-13)23-3/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyTVGVKKJIPQWYDL-UHFFFAOYSA-N
MW334.80 g/mol
LogP3.72
Rot. Bonds6

About 2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide

2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide (PubChem CID 26507119) has the molecular formula C17H19ClN2O3 and a molecular weight of 334.80 g/mol. Its IUPAC name is 2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide
PubChem CID26507119
Molecular FormulaC17H19ClN2O3
Molecular Weight334.80 g/mol
Exact Mass334.11
IUPAC Name2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)CNc2ccc(Cl)cc2C)cc(OC)c1
InChIInChI=1S/C17H19ClN2O3/c1-11-6-12(18)4-5-16(11)19-10-17(21)20-13-7-14(22-2)9-15(8-13)23-3/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyTVGVKKJIPQWYDL-UHFFFAOYSA-N
XLogP3.72
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.80
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)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-(4-chloro-2-methylanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 26507073
N-(3,5-dimethoxyphenyl)-2-(2-fluoroanilino)acetamide
CID 26417450
2-(5-chloro-2-methoxyanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 7694831
2-(4-chloro-2-methylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 109007918
2-(4-chloro-2-methylanilino)-N-(3-fluorophenyl)acetamide
CID 26507132
2-(3,4-dichloroanilino)-N-(3,5-dimethoxyphenyl)acetamide
CID 4796501
N-(2-chlorophenyl)-2-(4-methoxy-2-methylanilino)acetamide
CID 62871342
2-(4-methoxy-2-methylanilino)-N-(3-methylphenyl)acetamide
CID 62872071
N-(3,5-dimethoxyphenyl)-2-(2-iodoanilino)acetamide
CID 26506677
2-anilino-N-(3,5-dimethoxyphenyl)acetamide
CID 51178238
2-(4-chloroanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 26506560
4-[[2-(4-chloro-2-methylanilino)acetyl]amino]-N,N-dimethylbenzamide
CID 26507194

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide?
The IUPAC name of 2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide (CID 26507119) is 2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide?
The canonical SMILES for 2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide is COc1cc(NC(=O)CNc2ccc(Cl)cc2C)cc(OC)c1.
What is the InChIKey of 2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide?
The InChIKey is TVGVKKJIPQWYDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O3/c1-11-6-12(18)4-5-16(11)19-10-17(21)20-13-7-14(22-2)9-15(8-13)23-3/h4-9,19H,10H2,1-3H3,(H,20,21).
What are the key properties of 2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide?
2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide has a molecular weight of 334.80 g/mol, XLogP of 3.72, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methylanilino)-N-(3,5-dimethoxyphenyl)acetamide is sourced from PubChem (CID 26507119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).