N-methyl-3-(2-phenoxypropanoylamino)benzamide

C17H18N2O3 — CID 17233082

IUPACN-methyl-3-(2-phenoxypropanoylamino)benzamide
SMILESCNC(=O)c1cccc(NC(=O)C(C)Oc2ccccc2)c1
InChIInChI=1S/C17H18N2O3/c1-12(22-15-9-4-3-5-10-15)16(20)19-14-8-6-7-13(11-14)17(21)18-2/h3-12H,1-2H3,(H,18,21)(H,19,20)
InChIKeyVTIWPGBSIXXUDG-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.45
Rot. Bonds5

About N-methyl-3-(2-phenoxypropanoylamino)benzamide

N-methyl-3-(2-phenoxypropanoylamino)benzamide (PubChem CID 17233082) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-methyl-3-(2-phenoxypropanoylamino)benzamide.

Molecular Properties

Compound NameN-methyl-3-(2-phenoxypropanoylamino)benzamide
PubChem CID17233082
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-methyl-3-(2-phenoxypropanoylamino)benzamide
SMILESCNC(=O)c1cccc(NC(=O)C(C)Oc2ccccc2)c1
InChIInChI=1S/C17H18N2O3/c1-12(22-15-9-4-3-5-10-15)16(20)19-14-8-6-7-13(11-14)17(21)18-2/h3-12H,1-2H3,(H,18,21)(H,19,20)
InChIKeyVTIWPGBSIXXUDG-UHFFFAOYSA-N
XLogP2.45
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(2R)-2-phenoxypropanoyl]amino]benzoic acid
CID 974931
3-(2-phenoxypropanoylamino)-N-(1-phenylethyl)benzamide
CID 43877796
N-(2-methylpropyl)-3-[[(2R)-2-phenoxypropanoyl]amino]benzamide
CID 976970
N-phenyl-3-[2-(4-propan-2-ylphenoxy)propanoylamino]benzamide
CID 54781105
3-[2-(4-bromo-2,6-dimethylphenoxy)propanoylamino]-N-methylbenzamide
CID 17233132
5-[[(2S)-2-phenoxypropanoyl]amino]benzene-1,3-dicarboxylic acid
CID 878338
3-[2-(4-methylphenoxy)propanoylamino]-N-(3-methylphenyl)benzamide
CID 43877477
N-methyl-2-phenoxypropanamide
CID 4626974
N-methyl-4-[2-(3-methylphenoxy)propanoylamino]benzamide
CID 43888206
3-[2-(4-chlorophenoxy)propanoylamino]benzoic acid
CID 19176856
3-[2-(4-tert-butylphenoxy)propanoylamino]-N-propan-2-ylbenzamide
CID 17197514
3-(2-chloropropanoylamino)-N-methylbenzamide
CID 43244627

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(2-phenoxypropanoylamino)benzamide?
The IUPAC name of N-methyl-3-(2-phenoxypropanoylamino)benzamide (CID 17233082) is N-methyl-3-(2-phenoxypropanoylamino)benzamide.
What is the SMILES notation for N-methyl-3-(2-phenoxypropanoylamino)benzamide?
The canonical SMILES for N-methyl-3-(2-phenoxypropanoylamino)benzamide is CNC(=O)c1cccc(NC(=O)C(C)Oc2ccccc2)c1.
What is the InChIKey of N-methyl-3-(2-phenoxypropanoylamino)benzamide?
The InChIKey is VTIWPGBSIXXUDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-12(22-15-9-4-3-5-10-15)16(20)19-14-8-6-7-13(11-14)17(21)18-2/h3-12H,1-2H3,(H,18,21)(H,19,20).
What are the key properties of N-methyl-3-(2-phenoxypropanoylamino)benzamide?
N-methyl-3-(2-phenoxypropanoylamino)benzamide has a molecular weight of 298.34 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(2-phenoxypropanoylamino)benzamide is sourced from PubChem (CID 17233082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).