2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide

C22H20N2O3 — CID 94832090

IUPAC2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide
SMILESCOc1ccc(/N=C/c2ccc(OCC(=O)Nc3ccccc3)cc2)cc1
InChIInChI=1S/C22H20N2O3/c1-26-20-13-9-18(10-14-20)23-15-17-7-11-21(12-8-17)27-16-22(25)24-19-5-3-2-4-6-19/h2-15H,16H2,1H3,(H,24,25)/b23-15+
InChIKeyXYEHUUHREFTAHE-HZHRSRAPSA-N
MW360.41 g/mol
LogP4.46
Rot. Bonds7

About 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide

2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide (PubChem CID 94832090) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide
PubChem CID94832090
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC Name2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide
SMILESCOc1ccc(/N=C/c2ccc(OCC(=O)Nc3ccccc3)cc2)cc1
InChIInChI=1S/C22H20N2O3/c1-26-20-13-9-18(10-14-20)23-15-17-7-11-21(12-8-17)27-16-22(25)24-19-5-3-2-4-6-19/h2-15H,16H2,1H3,(H,24,25)/b23-15+
InChIKeyXYEHUUHREFTAHE-HZHRSRAPSA-N
XLogP4.46
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-[4-[(4-bromophenyl)iminomethyl]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 94832076
2-[4-[(Z)-[[2-(4-methoxyphenoxy)acetyl]hydrazinylidene]methyl]phenoxy]-N-phenylacetamide
CID 5429334
2-[2,6-dibromo-4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide
CID 126218291
N-(3-methylphenyl)-2-[4-[(4-phenoxyphenyl)iminomethyl]phenoxy]acetamide
CID 126217084
methyl 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]acetate
CID 94832083
2-[4-[(4-bromophenyl)iminomethyl]phenoxy]-N-(2-methoxyphenyl)acetamide
CID 94832081
2-[(4-methoxyphenyl)methylideneamino]-N-phenylacetamide
CID 70606724
2-(4-methoxyphenoxy)-N-(4-phenoxyphenyl)acetamide
CID 833180
N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide
CID 17231339
N-benzyl-N'-[(E)-[4-[2-(4-methoxyanilino)-2-oxoethoxy]phenyl]methylideneamino]propanediamide
CID 94832235
4-methoxy-N-[(Z)-[4-[2-(4-methoxyanilino)-2-oxoethoxy]phenyl]methylideneamino]benzamide
CID 92850497
2-[5-[(4-methoxyphenyl)iminomethyl]furan-2-yl]sulfanyl-N-phenylacetamide
CID 1266069

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide?
The IUPAC name of 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide (CID 94832090) is 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide.
What is the SMILES notation for 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide?
The canonical SMILES for 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide is COc1ccc(/N=C/c2ccc(OCC(=O)Nc3ccccc3)cc2)cc1.
What is the InChIKey of 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide?
The InChIKey is XYEHUUHREFTAHE-HZHRSRAPSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-26-20-13-9-18(10-14-20)23-15-17-7-11-21(12-8-17)27-16-22(25)24-19-5-3-2-4-6-19/h2-15H,16H2,1H3,(H,24,25)/b23-15+.
What are the key properties of 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide?
2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide has a molecular weight of 360.41 g/mol, XLogP of 4.46, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide is sourced from PubChem (CID 94832090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).