N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide

C16H16N2O6 — CID 7720081

IUPACN-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccccc1OC
InChIInChI=1S/C16H16N2O6/c1-22-13-5-3-4-6-14(13)24-10-16(19)17-12-8-7-11(18(20)21)9-15(12)23-2/h3-9H,10H2,1-2H3,(H,17,19)
InChIKeyHAFWGVQUJPGYSG-UHFFFAOYSA-N
MW332.31 g/mol
LogP2.63
Rot. Bonds7

About N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide

N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide (PubChem CID 7720081) has the molecular formula C16H16N2O6 and a molecular weight of 332.31 g/mol. Its IUPAC name is N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide
PubChem CID7720081
Molecular FormulaC16H16N2O6
Molecular Weight332.31 g/mol
Exact Mass332.10
IUPAC NameN-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccccc1OC
InChIInChI=1S/C16H16N2O6/c1-22-13-5-3-4-6-14(13)24-10-16(19)17-12-8-7-11(18(20)21)9-15(12)23-2/h3-9H,10H2,1-2H3,(H,17,19)
InChIKeyHAFWGVQUJPGYSG-UHFFFAOYSA-N
XLogP2.63
TPSA99.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.31
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

N-(2-methoxy-4-nitrophenyl)-4-(2-methoxyphenoxy)butanamide
CID 2954646
2-(2,4-dinitrophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 17359269
N-benzyl-2-[2-(2-methoxy-4-nitroanilino)-2-oxoethoxy]benzamide
CID 18077087
2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 2903084
[2-(2-methoxy-4-nitroanilino)-2-oxoethyl] 2-phenoxyacetate
CID 4151536
2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 8010465
[2-(2-methoxy-4-nitroanilino)-2-oxoethyl] pyridine-2-carboxylate
CID 7776690
[2-(2-methoxy-4-nitroanilino)-2-oxoethyl] 3-(2-methoxyphenyl)propanoate
CID 8524359
N-(2-methoxy-5-nitrophenyl)-2-(2-propan-2-ylphenoxy)acetamide
CID 927147
methyl 4-(2-methoxy-4-nitroanilino)-4-oxobutanoate
CID 54781631
2-(ethylamino)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 60641116
2,6-dimethoxy-N-(2-methoxy-4-nitrophenyl)benzamide
CID 4285710

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide (CID 7720081) is N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide is COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccccc1OC.
What is the InChIKey of N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide?
The InChIKey is HAFWGVQUJPGYSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O6/c1-22-13-5-3-4-6-14(13)24-10-16(19)17-12-8-7-11(18(20)21)9-15(12)23-2/h3-9H,10H2,1-2H3,(H,17,19).
What are the key properties of N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide?
N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide has a molecular weight of 332.31 g/mol, XLogP of 2.63, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 7720081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).