2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide

C15H12Cl2N2O5 — CID 2903084

IUPAC2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
SMILESCOc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H12Cl2N2O5/c1-23-14-7-10(19(21)22)3-4-12(14)18-15(20)8-24-13-5-2-9(16)6-11(13)17/h2-7H,8H2,1H3,(H,18,20)
InChIKeyMPOJMFAWRCJOMF-UHFFFAOYSA-N
MW371.18 g/mol
LogP3.93
Rot. Bonds6

About 2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide

2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide (PubChem CID 2903084) has the molecular formula C15H12Cl2N2O5 and a molecular weight of 371.18 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
PubChem CID2903084
Molecular FormulaC15H12Cl2N2O5
Molecular Weight371.18 g/mol
Exact Mass370.01
IUPAC Name2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
SMILESCOc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H12Cl2N2O5/c1-23-14-7-10(19(21)22)3-4-12(14)18-15(20)8-24-13-5-2-9(16)6-11(13)17/h2-7H,8H2,1H3,(H,18,20)
InChIKeyMPOJMFAWRCJOMF-UHFFFAOYSA-N
XLogP3.93
TPSA90.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.18
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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-dinitrophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 17359269
N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide
CID 7720081
2-(2-chloro-4-nitrophenoxy)-N-(2,5-dimethoxyphenyl)acetamide
CID 2513285
N-(5-chloro-2-methoxyphenyl)-2-(2-methyl-4-nitrophenoxy)acetamide
CID 1406721
2-(2-chloro-4-nitrophenoxy)-N-(5-chloro-2-nitrophenyl)acetamide
CID 7865806
N-(5-acetamido-2-methoxyphenyl)-2-(2-chloro-4-nitrophenoxy)acetamide
CID 8587959
2-(4-chlorophenyl)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 2892197
N-(2,4-dichlorophenyl)-2-(2-formyl-4-nitrophenoxy)acetamide
CID 34744103
N-(5-chloro-2-methoxyphenyl)-2-[4-nitro-2-(trifluoromethyl)phenoxy]acetamide
CID 47771816
2-(2-chloro-4-phenylphenoxy)-N-(2-methoxy-5-nitrophenyl)acetamide
CID 7653192
N-(2-chloro-5-nitrophenyl)-2-(2-methoxy-4-methylphenoxy)acetamide
CID 17359240
2-(4-chloro-2-nitrophenoxy)-N-(2,4-dimethoxyphenyl)acetamide
CID 31728423

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide (CID 2903084) is 2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide is COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide?
The InChIKey is MPOJMFAWRCJOMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O5/c1-23-14-7-10(19(21)22)3-4-12(14)18-15(20)8-24-13-5-2-9(16)6-11(13)17/h2-7H,8H2,1H3,(H,18,20).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide?
2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide has a molecular weight of 371.18 g/mol, XLogP of 3.93, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide is sourced from PubChem (CID 2903084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).