2-(N-benzylanilino)-N-(4-methylphenyl)acetamide

C22H22N2O — CID 109007221

IUPAC2-(N-benzylanilino)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)CN(Cc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C22H22N2O/c1-18-12-14-20(15-13-18)23-22(25)17-24(21-10-6-3-7-11-21)16-19-8-4-2-5-9-19/h2-15H,16-17H2,1H3,(H,23,25)
InChIKeyICGRDBAMHVFOQV-UHFFFAOYSA-N
MW330.43 g/mol
LogP4.64
Rot. Bonds6

About 2-(N-benzylanilino)-N-(4-methylphenyl)acetamide

2-(N-benzylanilino)-N-(4-methylphenyl)acetamide (PubChem CID 109007221) has the molecular formula C22H22N2O and a molecular weight of 330.43 g/mol. Its IUPAC name is 2-(N-benzylanilino)-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-benzylanilino)-N-(4-methylphenyl)acetamide
PubChem CID109007221
Molecular FormulaC22H22N2O
Molecular Weight330.43 g/mol
Exact Mass330.17
IUPAC Name2-(N-benzylanilino)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)CN(Cc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C22H22N2O/c1-18-12-14-20(15-13-18)23-22(25)17-24(21-10-6-3-7-11-21)16-19-8-4-2-5-9-19/h2-15H,16-17H2,1H3,(H,23,25)
InChIKeyICGRDBAMHVFOQV-UHFFFAOYSA-N
XLogP4.64
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(dibenzylamino)-N-(4-methylphenyl)acetamide
CID 18870817
2-(4-methyl-N-[2-(4-methylanilino)-2-oxoethyl]anilino)-N-(4-methylphenyl)acetamide
CID 2645683
N-(4-methylphenyl)-2-[methyl(2-phenylethyl)amino]acetamide
CID 8785343
N-(2-acetamidoethyl)-2-(N-benzyl-4-methylanilino)acetamide
CID 78825845
2-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]acetamide
CID 27133835
2-[benzenesulfonyl(benzyl)amino]-N-(4-methylphenyl)acetamide
CID 2854852
2-(N-benzylanilino)-N-(2-bromophenyl)acetamide
CID 109010688
2-(N-benzyl-3-methylanilino)-N-[(4-methylphenyl)methyl]acetamide
CID 18230288
N-(4-methylphenyl)-3-phenylpropanamide
CID 778861
2-[benzyl(ethyl)amino]-N-[4-(dimethylamino)phenyl]acetamide
CID 108998932
2-(N-ethyl-3-fluoroanilino)-N-(4-methylphenyl)acetamide
CID 60517438
2-[[2-[benzyl(2-methoxyethyl)amino]-2-oxoethyl]-methylamino]-N-(4-methylphenyl)acetamide
CID 8785766

Frequently Asked Questions

What is the IUPAC name of 2-(N-benzylanilino)-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(N-benzylanilino)-N-(4-methylphenyl)acetamide (CID 109007221) is 2-(N-benzylanilino)-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(N-benzylanilino)-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(N-benzylanilino)-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)CN(Cc2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 2-(N-benzylanilino)-N-(4-methylphenyl)acetamide?
The InChIKey is ICGRDBAMHVFOQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O/c1-18-12-14-20(15-13-18)23-22(25)17-24(21-10-6-3-7-11-21)16-19-8-4-2-5-9-19/h2-15H,16-17H2,1H3,(H,23,25).
What are the key properties of 2-(N-benzylanilino)-N-(4-methylphenyl)acetamide?
2-(N-benzylanilino)-N-(4-methylphenyl)acetamide has a molecular weight of 330.43 g/mol, XLogP of 4.64, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-benzylanilino)-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 109007221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).