N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide

C17H17NO5 — CID 94762984

IUPACN-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccc(C=O)cc1NC(=O)COc1ccccc1OC
InChIInChI=1S/C17H17NO5/c1-21-14-8-7-12(10-19)9-13(14)18-17(20)11-23-16-6-4-3-5-15(16)22-2/h3-10H,11H2,1-2H3,(H,18,20)
InChIKeyKQCRFINNUJXVGG-UHFFFAOYSA-N
MW315.33 g/mol
LogP2.53
Rot. Bonds7

About N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide

N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide (PubChem CID 94762984) has the molecular formula C17H17NO5 and a molecular weight of 315.33 g/mol. Its IUPAC name is N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide
PubChem CID94762984
Molecular FormulaC17H17NO5
Molecular Weight315.33 g/mol
Exact Mass315.11
IUPAC NameN-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccc(C=O)cc1NC(=O)COc1ccccc1OC
InChIInChI=1S/C17H17NO5/c1-21-14-8-7-12(10-19)9-13(14)18-17(20)11-23-16-6-4-3-5-15(16)22-2/h3-10H,11H2,1-2H3,(H,18,20)
InChIKeyKQCRFINNUJXVGG-UHFFFAOYSA-N
XLogP2.53
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.33
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-(2-ethoxy-5-formylphenyl)-2-(2-methoxyphenoxy)acetamide
CID 82156183
2-(2-bromo-4-formylphenoxy)-N-(2-methoxyphenyl)acetamide
CID 3955556
2-(5-formyl-2-methoxyphenoxy)-N-phenylacetamide
CID 7611771
N-(5-formyl-2-methoxyphenyl)-2-phenylacetamide
CID 82156108
2-(4-formyl-2,6-dimethylphenoxy)-N-(2-methoxyphenyl)acetamide
CID 7696129
2-bromo-N-(5-formyl-2-methoxyphenyl)acetamide
CID 169448896
2-(4-formyl-2-methoxyphenoxy)-N-(2,4,5-trichlorophenyl)acetamide
CID 7894136
2-(5-formyl-2-methoxyphenoxy)-N-(2,4,5-trichlorophenyl)acetamide
CID 7611792
N-(3-chloro-2-methylphenyl)-2-(5-formyl-2-methoxyphenoxy)acetamide
CID 28913395
N-carbamoyl-2-(4-formyl-2-methoxyphenoxy)acetamide
CID 24694058
2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 7128211
N-(2-acetamidophenyl)-2-(2-methoxyphenoxy)acetamide
CID 3601272

Frequently Asked Questions

What is the IUPAC name of N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide (CID 94762984) is N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide is COc1ccc(C=O)cc1NC(=O)COc1ccccc1OC.
What is the InChIKey of N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide?
The InChIKey is KQCRFINNUJXVGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO5/c1-21-14-8-7-12(10-19)9-13(14)18-17(20)11-23-16-6-4-3-5-15(16)22-2/h3-10H,11H2,1-2H3,(H,18,20).
What are the key properties of N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide?
N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide has a molecular weight of 315.33 g/mol, XLogP of 2.53, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 94762984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).