N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide

C19H22N2O4 — CID 17218253

IUPACN-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide
SMILESCOCCNC(=O)c1ccc(NC(=O)C(C)Oc2ccccc2)cc1
InChIInChI=1S/C19H22N2O4/c1-14(25-17-6-4-3-5-7-17)18(22)21-16-10-8-15(9-11-16)19(23)20-12-13-24-2/h3-11,14H,12-13H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyAXDKFIQJXJXNEV-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.47
Rot. Bonds8

About N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide

N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide (PubChem CID 17218253) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide
PubChem CID17218253
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide
SMILESCOCCNC(=O)c1ccc(NC(=O)C(C)Oc2ccccc2)cc1
InChIInChI=1S/C19H22N2O4/c1-14(25-17-6-4-3-5-7-17)18(22)21-16-10-8-15(9-11-16)19(23)20-12-13-24-2/h3-11,14H,12-13H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyAXDKFIQJXJXNEV-UHFFFAOYSA-N
XLogP2.47
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-4-[2-(4-methylphenoxy)propanoylamino]benzamide
CID 17218246
4-[2-(4-chlorophenoxy)propanoylamino]-N-(2-methoxyethyl)benzamide
CID 17218257
N-(2-methoxyethyl)-4-[2-(2-methoxyphenoxy)propanoylamino]benzamide
CID 17218256
(2S)-N-(2-methoxyethyl)-2-phenoxypropanamide
CID 2162450
N-[2-[[4-(2-phenoxypropanoylamino)benzoyl]amino]ethyl]furan-2-carboxamide
CID 121062862
N-(3-methoxypropyl)-4-[2-(4-propan-2-ylphenoxy)propanoylamino]benzamide
CID 17205110
N-(2-methoxyethyl)-4-[2-(2-nitrophenoxy)propanoylamino]benzamide
CID 17218280
4-[[(2S)-2-phenoxypropanoyl]amino]benzoic acid
CID 1365740
N-benzyl-4-[1-oxo-1-(4-phenoxyanilino)propan-2-yl]oxybenzamide
CID 4252954
N-(4-acetamidophenyl)-2-phenoxypropanamide
CID 2897872
N-(2-methoxyethyl)-3-[2-(3-methylphenoxy)propanoylamino]benzamide
CID 17218985
4-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide
CID 17218775

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide?
The IUPAC name of N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide (CID 17218253) is N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide?
The canonical SMILES for N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide is COCCNC(=O)c1ccc(NC(=O)C(C)Oc2ccccc2)cc1.
What is the InChIKey of N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide?
The InChIKey is AXDKFIQJXJXNEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-14(25-17-6-4-3-5-7-17)18(22)21-16-10-8-15(9-11-16)19(23)20-12-13-24-2/h3-11,14H,12-13H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide?
N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide has a molecular weight of 342.40 g/mol, XLogP of 2.47, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-4-(2-phenoxypropanoylamino)benzamide is sourced from PubChem (CID 17218253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).