2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide

C23H23N3O2 — CID 9106347

IUPAC2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)CNc2ccccc2C(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C23H23N3O2/c1-16-7-11-18(12-8-16)25-22(27)15-24-21-6-4-3-5-20(21)23(28)26-19-13-9-17(2)10-14-19/h3-14,24H,15H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyIEISRZGNISFCLX-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.61
Rot. Bonds6

About 2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide

2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide (PubChem CID 9106347) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide.

Molecular Properties

Compound Name2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide
PubChem CID9106347
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC Name2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)CNc2ccccc2C(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C23H23N3O2/c1-16-7-11-18(12-8-16)25-22(27)15-24-21-6-4-3-5-20(21)23(28)26-19-13-9-17(2)10-14-19/h3-14,24H,15H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyIEISRZGNISFCLX-UHFFFAOYSA-N
XLogP4.61
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-2-[[2-(4-methylanilino)-2-oxoethyl]amino]benzamide
CID 18205586
2-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide
CID 9106324
2-[[2-(2-chloro-4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide
CID 9106367
N-(4-methylphenyl)-2-(propylamino)benzamide
CID 62166798
2-[(2-anilino-2-oxoethyl)amino]-N-(4-methoxyphenyl)benzamide
CID 9105493
2-(2-methylanilino)-N-(4-methylphenyl)acetamide
CID 7636705
2-[[2-(2,4-dimethylanilino)-2-oxoethyl]amino]-N-phenylbenzamide
CID 9105938
2-(2-acetylanilino)-N-phenylacetamide
CID 9103782
N-(4-chlorophenyl)-2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]benzamide
CID 9084498
2-[[2-(3-fluoro-4-methylanilino)-2-oxoethyl]amino]-N-(4-fluorophenyl)benzamide
CID 9104019
2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide
CID 9103726
2-[[2-[4-(dimethylamino)anilino]-2-oxoethyl]amino]-N-(4-methoxyphenyl)benzamide
CID 9105472

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide?
The IUPAC name of 2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide (CID 9106347) is 2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide.
What is the SMILES notation for 2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide?
The canonical SMILES for 2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide is Cc1ccc(NC(=O)CNc2ccccc2C(=O)Nc2ccc(C)cc2)cc1.
What is the InChIKey of 2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide?
The InChIKey is IEISRZGNISFCLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-16-7-11-18(12-8-16)25-22(27)15-24-21-6-4-3-5-20(21)23(28)26-19-13-9-17(2)10-14-19/h3-14,24H,15H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide?
2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide has a molecular weight of 373.46 g/mol, XLogP of 4.61, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide is sourced from PubChem (CID 9106347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).