N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide

C19H20N2O4 — CID 7763027

IUPACN-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide
SMILESCc1cccc(NC(=O)CNC(=O)COc2ccccc2C=O)c1C
InChIInChI=1S/C19H20N2O4/c1-13-6-5-8-16(14(13)2)21-18(23)10-20-19(24)12-25-17-9-4-3-7-15(17)11-22/h3-9,11H,10,12H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyVBHHPWVXPIKRQA-UHFFFAOYSA-N
MW340.38 g/mol
LogP2.25
Rot. Bonds7

About N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide

N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide (PubChem CID 7763027) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide
PubChem CID7763027
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC NameN-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide
SMILESCc1cccc(NC(=O)CNC(=O)COc2ccccc2C=O)c1C
InChIInChI=1S/C19H20N2O4/c1-13-6-5-8-16(14(13)2)21-18(23)10-20-19(24)12-25-17-9-4-3-7-15(17)11-22/h3-9,11H,10,12H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyVBHHPWVXPIKRQA-UHFFFAOYSA-N
XLogP2.25
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2,3-dimethylphenyl)-2-[[2-(2-fluorophenoxy)acetyl]amino]acetamide
CID 7501086
N-(2,3-dimethylphenyl)-2-[[2-(4-methylphenoxy)acetyl]amino]acetamide
CID 27808986
N'-[(Z)-[2-[2-(2,3-dimethylanilino)-2-oxoethoxy]phenyl]methylideneamino]-N-(2,3-dimethylphenyl)oxamide
CID 126165878
2-(2-acetamidophenoxy)-N-(2,3-dimethylphenyl)acetamide
CID 2566695
2-[[2-(2-methoxyphenoxy)acetyl]amino]-N-(2-methylphenyl)acetamide
CID 112996058
N-(2-bromophenyl)-2-[[2-(2-methylphenoxy)acetyl]amino]acetamide
CID 8503107
2-[(2-bromoacetyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 55246569
2-[[2-(2-acetyl-4-chlorophenoxy)acetyl]amino]-N-(2,3-dimethylphenyl)acetamide
CID 2594718
2-[[2-(3-chlorophenoxy)acetyl]amino]-N-(2,3-dimethylphenyl)acetamide
CID 7858908
2-(2-formyl-6-methylphenoxy)-N-(2-methylphenyl)acetamide
CID 115955536
2-(2-formylphenoxy)-N-[2-(2-phenylethoxy)phenyl]acetamide
CID 60513932
(E)-N-benzyl-2-cyano-3-[2-[2-(2,3-dimethylanilino)-2-oxoethoxy]phenyl]prop-2-enamide
CID 126268791

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide (CID 7763027) is N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide is Cc1cccc(NC(=O)CNC(=O)COc2ccccc2C=O)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide?
The InChIKey is VBHHPWVXPIKRQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-13-6-5-8-16(14(13)2)21-18(23)10-20-19(24)12-25-17-9-4-3-7-15(17)11-22/h3-9,11H,10,12H2,1-2H3,(H,20,24)(H,21,23).
What are the key properties of N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide?
N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide has a molecular weight of 340.38 g/mol, XLogP of 2.25, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-[[2-(2-formylphenoxy)acetyl]amino]acetamide is sourced from PubChem (CID 7763027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).