2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide

C15H12Cl2N2O4 — CID 9268719

IUPAC2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide
SMILESCOc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H12Cl2N2O4/c1-23-14-5-4-11(19(21)22)8-13(14)18-15(20)6-9-2-3-10(16)7-12(9)17/h2-5,7-8H,6H2,1H3,(H,18,20)
InChIKeyCKHUORVDVKHDGV-UHFFFAOYSA-N
MW355.18 g/mol
LogP4.09
Rot. Bonds5

About 2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide

2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide (PubChem CID 9268719) has the molecular formula C15H12Cl2N2O4 and a molecular weight of 355.18 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide
PubChem CID9268719
Molecular FormulaC15H12Cl2N2O4
Molecular Weight355.18 g/mol
Exact Mass354.02
IUPAC Name2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide
SMILESCOc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H12Cl2N2O4/c1-23-14-5-4-11(19(21)22)8-13(14)18-15(20)6-9-2-3-10(16)7-12(9)17/h2-5,7-8H,6H2,1H3,(H,18,20)
InChIKeyCKHUORVDVKHDGV-UHFFFAOYSA-N
XLogP4.09
TPSA81.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.18
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 112771738
1-(2,5-dichlorophenyl)-3-(2-methoxy-5-nitrophenyl)urea
CID 108886216
2-(2,4-dimethoxyphenyl)-N-(2-methoxy-5-nitrophenyl)acetamide
CID 16913165
4-(5-chloro-2-methoxyphenyl)-N-(2-methoxy-5-nitrophenyl)-4-oxobutanamide
CID 108797085
1-(5-chloro-2-methoxyphenyl)-3-(2-methoxy-4-nitrophenyl)urea
CID 108875488
N-(5-chloro-2-methoxyphenyl)-2-[(2-methoxy-5-nitrophenyl)methyl-methylamino]acetamide
CID 27245257
3-(2-methoxy-5-nitroanilino)-3-oxopropanoic acid
CID 62230736
2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 2903084
N-(5-chloro-2-methoxyphenyl)-2-(2-methyl-4-nitrophenoxy)acetamide
CID 1406721
2-(4-chlorophenyl)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 2892197
3-[(4-chlorophenyl)sulfonylamino]-N-(2-methoxy-5-nitrophenyl)propanamide
CID 17225629
N-(5-chloro-2-methoxyphenyl)-2-(2-chlorophenyl)acetamide
CID 2666806

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide (CID 9268719) is 2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide is COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide?
The InChIKey is CKHUORVDVKHDGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O4/c1-23-14-5-4-11(19(21)22)8-13(14)18-15(20)6-9-2-3-10(16)7-12(9)17/h2-5,7-8H,6H2,1H3,(H,18,20).
What are the key properties of 2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide?
2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide has a molecular weight of 355.18 g/mol, XLogP of 4.09, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-(2-methoxy-5-nitrophenyl)acetamide is sourced from PubChem (CID 9268719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).