4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide

C22H18Cl2N2O3 — CID 26522654

IUPAC4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C22H18Cl2N2O3/c1-29-20-5-3-2-4-19(20)26-22(28)15-7-9-16(10-8-15)25-21(27)13-14-6-11-17(23)18(24)12-14/h2-12H,13H2,1H3,(H,25,27)(H,26,28)
InChIKeyMLKMJCRVMWNNSP-UHFFFAOYSA-N
MW429.30 g/mol
LogP5.44
Rot. Bonds6

About 4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide

4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide (PubChem CID 26522654) has the molecular formula C22H18Cl2N2O3 and a molecular weight of 429.30 g/mol. Its IUPAC name is 4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide
PubChem CID26522654
Molecular FormulaC22H18Cl2N2O3
Molecular Weight429.30 g/mol
Exact Mass428.07
IUPAC Name4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C22H18Cl2N2O3/c1-29-20-5-3-2-4-19(20)26-22(28)15-7-9-16(10-8-15)25-21(27)13-14-6-11-17(23)18(24)12-14/h2-12H,13H2,1H3,(H,25,27)(H,26,28)
InChIKeyMLKMJCRVMWNNSP-UHFFFAOYSA-N
XLogP5.44
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500429.30
LogP ≤ 55.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(benzamidocarbamoyl)phenyl]-2-(3-chloro-4-methoxyphenyl)acetamide
CID 71656387
N-(2-methoxyphenyl)-4-[3-(2-methoxyphenyl)propanoylamino]benzamide
CID 7998968
2-(4-acetamidophenyl)-N-(2-methoxyphenyl)acetamide
CID 17410326
4-[[2-[(2-chlorophenyl)methyl-methylamino]acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 4788052
N-(2-methoxyphenyl)-4-[3-(4-methoxyphenyl)propanoylamino]benzamide
CID 7929170
4-[[2-[[(1R)-1-(2,4-dichlorophenyl)ethyl]amino]acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 40941991
4-[[2-(4-chlorophenoxy)acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 7816201
4-[[2-(2-methoxyethoxy)acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 43037458
4-[(2-chlorophenoxy)methyl]-N-(2-methoxyphenyl)benzamide
CID 1223749
N-(2,5-dimethoxyphenyl)-4-[(2-phenylacetyl)amino]benzamide
CID 17119475
4-chloro-N-[2-[[2-(3-methoxy-4-methylphenyl)acetyl]amino]phenyl]benzamide
CID 31967245
N-(3,4-dichlorophenyl)-2-(2-methoxyanilino)acetamide
CID 9080426

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide?
The IUPAC name of 4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide (CID 26522654) is 4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide.
What is the SMILES notation for 4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide?
The canonical SMILES for 4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide is COc1ccccc1NC(=O)c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1.
What is the InChIKey of 4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide?
The InChIKey is MLKMJCRVMWNNSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18Cl2N2O3/c1-29-20-5-3-2-4-19(20)26-22(28)15-7-9-16(10-8-15)25-21(27)13-14-6-11-17(23)18(24)12-14/h2-12H,13H2,1H3,(H,25,27)(H,26,28).
What are the key properties of 4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide?
4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide has a molecular weight of 429.30 g/mol, XLogP of 5.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(3,4-dichlorophenyl)acetyl]amino]-N-(2-methoxyphenyl)benzamide is sourced from PubChem (CID 26522654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).