N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide

C20H24N2O — CID 9287588

IUPACN-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide
SMILESCc1cccc(NC(=O)CN(C)C/C=C/c2ccccc2)c1C
InChIInChI=1S/C20H24N2O/c1-16-9-7-13-19(17(16)2)21-20(23)15-22(3)14-8-12-18-10-5-4-6-11-18/h4-13H,14-15H2,1-3H3,(H,21,23)/b12-8+
InChIKeyVGEJUCHHAPHUTL-XYOKQWHBSA-N
MW308.43 g/mol
LogP3.89
Rot. Bonds6

About N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide

N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide (PubChem CID 9287588) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide
PubChem CID9287588
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC NameN-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide
SMILESCc1cccc(NC(=O)CN(C)C/C=C/c2ccccc2)c1C
InChIInChI=1S/C20H24N2O/c1-16-9-7-13-19(17(16)2)21-20(23)15-22(3)14-8-12-18-10-5-4-6-11-18/h4-13H,14-15H2,1-3H3,(H,21,23)/b12-8+
InChIKeyVGEJUCHHAPHUTL-XYOKQWHBSA-N
XLogP3.89
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dimethylphenyl)-2-[methyl-[2-[methyl-[(1R)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide
CID 9348322
N-(2,3-dimethylphenyl)-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanamide
CID 109030036
N,N'-bis(2,3-dimethylphenyl)butanediamide
CID 4250073
N-(2,3-dimethylphenyl)-2-[methyl-[2-(methylcarbamoylamino)-2-oxoethyl]amino]acetamide
CID 9287446
ethyl 2-[methyl(3-phenylprop-2-enyl)amino]acetate
CID 76932222
2-[(2-bromophenyl)methyl-methylamino]-N-(2,3-dimethylphenyl)acetamide
CID 27204661
2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-methylamino]-N-(3-phenylpropyl)acetamide
CID 40717867
N-(2,3-dimethylphenyl)-2-[dimethylsulfamoyl(methyl)amino]acetamide
CID 35329527
2-[(2,6-dichlorophenyl)methyl-methylamino]-N-(2,3-dimethylphenyl)acetamide
CID 9287814
N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methylbutanamide
CID 27807926
2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-methylamino]-2-methylpropanoic acid
CID 62820404
2-[(4-bromophenyl)methyl-methylamino]-N-(2,3-dimethylphenyl)acetamide
CID 2657308

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide (CID 9287588) is N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide is Cc1cccc(NC(=O)CN(C)C/C=C/c2ccccc2)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide?
The InChIKey is VGEJUCHHAPHUTL-XYOKQWHBSA-N. The full InChI is InChI=1S/C20H24N2O/c1-16-9-7-13-19(17(16)2)21-20(23)15-22(3)14-8-12-18-10-5-4-6-11-18/h4-13H,14-15H2,1-3H3,(H,21,23)/b12-8+.
What are the key properties of N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide?
N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide has a molecular weight of 308.43 g/mol, XLogP of 3.89, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-[methyl-[(E)-3-phenylprop-2-enyl]amino]acetamide is sourced from PubChem (CID 9287588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).