2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide

C19H20Cl2N2O3 — CID 113171816

IUPAC2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
SMILESCOc1cc(Cl)c(C)cc1NC(=O)CN(C(C)=O)c1cccc(Cl)c1C
InChIInChI=1S/C19H20Cl2N2O3/c1-11-8-16(18(26-4)9-15(11)21)22-19(25)10-23(13(3)24)17-7-5-6-14(20)12(17)2/h5-9H,10H2,1-4H3,(H,22,25)
InChIKeyKTVMRDVBCQZDHT-UHFFFAOYSA-N
MW395.29 g/mol
LogP4.61
Rot. Bonds5

About 2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide

2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide (PubChem CID 113171816) has the molecular formula C19H20Cl2N2O3 and a molecular weight of 395.29 g/mol. Its IUPAC name is 2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
PubChem CID113171816
Molecular FormulaC19H20Cl2N2O3
Molecular Weight395.29 g/mol
Exact Mass394.09
IUPAC Name2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
SMILESCOc1cc(Cl)c(C)cc1NC(=O)CN(C(C)=O)c1cccc(Cl)c1C
InChIInChI=1S/C19H20Cl2N2O3/c1-11-8-16(18(26-4)9-15(11)21)22-19(25)10-23(13(3)24)17-7-5-6-14(20)12(17)2/h5-9H,10H2,1-4H3,(H,22,25)
InChIKeyKTVMRDVBCQZDHT-UHFFFAOYSA-N
XLogP4.61
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.29
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-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-2-fluoroanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 113170889
2-(N-acetyl-3-chloro-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 113171767
2-(N-acetyl-3-chloro-2-methylanilino)-N-(3-chloro-4-methylphenyl)acetamide
CID 113171770
2-(N-acetyl-4-ethoxyanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 113174007
2-(N-acetyl-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 113167376
2-(N-acetyl-4-chloro-2-methoxy-5-methylanilino)-N-quinolin-8-ylacetamide
CID 113180385
2-(N-acetyl-3-chloro-2-methylanilino)-N-(3,4-difluorophenyl)acetamide
CID 113171824
N-(4-chloro-2-methoxy-5-methylphenyl)-2-[(3-chlorophenyl)methyl-methylamino]acetamide
CID 27249569
1-(4-chloro-2-methoxy-5-methylphenyl)-3-(3-chloro-2-methylphenyl)urea
CID 108991794
2-[acetyl(propyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 113158086
2-(N-acetyl-2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide
CID 113171195
2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 113160569

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide (CID 113171816) is 2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide is COc1cc(Cl)c(C)cc1NC(=O)CN(C(C)=O)c1cccc(Cl)c1C.
What is the InChIKey of 2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide?
The InChIKey is KTVMRDVBCQZDHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O3/c1-11-8-16(18(26-4)9-15(11)21)22-19(25)10-23(13(3)24)17-7-5-6-14(20)12(17)2/h5-9H,10H2,1-4H3,(H,22,25).
What are the key properties of 2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide?
2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide has a molecular weight of 395.29 g/mol, XLogP of 4.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-3-chloro-2-methylanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide is sourced from PubChem (CID 113171816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).