2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide

C22H19N3O4 — CID 7894150

IUPAC2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide
SMILESCOc1cc(C=O)ccc1OCC(=O)Nc1ccc(/N=N/c2ccccc2)cc1
InChIInChI=1S/C22H19N3O4/c1-28-21-13-16(14-26)7-12-20(21)29-15-22(27)23-17-8-10-19(11-9-17)25-24-18-5-3-2-4-6-18/h2-14H,15H2,1H3,(H,23,27)/b25-24+
InChIKeyBXUGTYBIGJTJAF-OCOZRVBESA-N
MW389.41 g/mol
LogP4.94
Rot. Bonds8

About 2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide

2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide (PubChem CID 7894150) has the molecular formula C22H19N3O4 and a molecular weight of 389.41 g/mol. Its IUPAC name is 2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide
PubChem CID7894150
Molecular FormulaC22H19N3O4
Molecular Weight389.41 g/mol
Exact Mass389.14
IUPAC Name2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide
SMILESCOc1cc(C=O)ccc1OCC(=O)Nc1ccc(/N=N/c2ccccc2)cc1
InChIInChI=1S/C22H19N3O4/c1-28-21-13-16(14-26)7-12-20(21)29-15-22(27)23-17-8-10-19(11-9-17)25-24-18-5-3-2-4-6-18/h2-14H,15H2,1H3,(H,23,27)/b25-24+
InChIKeyBXUGTYBIGJTJAF-OCOZRVBESA-N
XLogP4.94
TPSA89.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.41
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

2-(5-formyl-2-methoxyphenoxy)-N-phenylacetamide
CID 7611771
2-(2-ethoxy-4-formylphenoxy)-N-phenylacetamide
CID 844203
N-(4-bromophenyl)-2-(5-formyl-2-methoxyphenoxy)acetamide
CID 7611543
2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 18279710
2-(4-formyl-2-methoxyphenoxy)-N-(4-piperidin-1-ylphenyl)acetamide
CID 26654844
N'-[(Z)-[4-(2-anilino-2-oxoethoxy)-3-methoxyphenyl]methylideneamino]-N-(4-fluorophenyl)oxamide
CID 126269910
N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide
CID 94762984
butyl 4-[[2-(4-formyl-2-methoxyphenoxy)acetyl]amino]benzoate
CID 7894174
2-[2-methoxy-4-[(Z)-(phenylcarbamoylhydrazinylidene)methyl]phenoxy]-N-(4-methylphenyl)acetamide
CID 126014913
2-[4-[(benzylhydrazinylidene)methyl]-2-methoxyphenoxy]-N-(4-methylphenyl)acetamide
CID 110839716
N-[4-(difluoromethoxy)phenyl]-2-(5-formyl-2-methoxyphenoxy)acetamide
CID 7612096
N-carbamoyl-2-(4-formyl-2-methoxyphenoxy)acetamide
CID 24694058

Frequently Asked Questions

What is the IUPAC name of 2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide?
The IUPAC name of 2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide (CID 7894150) is 2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide.
What is the SMILES notation for 2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide?
The canonical SMILES for 2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide is COc1cc(C=O)ccc1OCC(=O)Nc1ccc(/N=N/c2ccccc2)cc1.
What is the InChIKey of 2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide?
The InChIKey is BXUGTYBIGJTJAF-OCOZRVBESA-N. The full InChI is InChI=1S/C22H19N3O4/c1-28-21-13-16(14-26)7-12-20(21)29-15-22(27)23-17-8-10-19(11-9-17)25-24-18-5-3-2-4-6-18/h2-14H,15H2,1H3,(H,23,27)/b25-24+.
What are the key properties of 2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide?
2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide has a molecular weight of 389.41 g/mol, XLogP of 4.94, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-formyl-2-methoxyphenoxy)-N-(4-phenyldiazenylphenyl)acetamide is sourced from PubChem (CID 7894150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).