N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide

C22H21N3O2 — CID 55736923

IUPACN-(3-acetamidophenyl)-2-(N-methylanilino)benzamide
SMILESCC(=O)Nc1cccc(NC(=O)c2ccccc2N(C)c2ccccc2)c1
InChIInChI=1S/C22H21N3O2/c1-16(26)23-17-9-8-10-18(15-17)24-22(27)20-13-6-7-14-21(20)25(2)19-11-4-3-5-12-19/h3-15H,1-2H3,(H,23,26)(H,24,27)
InChIKeyDHABMLMHXMIZCV-UHFFFAOYSA-N
MW359.43 g/mol
LogP4.67
Rot. Bonds5

About N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide

N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide (PubChem CID 55736923) has the molecular formula C22H21N3O2 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-(N-methylanilino)benzamide
PubChem CID55736923
Molecular FormulaC22H21N3O2
Molecular Weight359.43 g/mol
Exact Mass359.16
IUPAC NameN-(3-acetamidophenyl)-2-(N-methylanilino)benzamide
SMILESCC(=O)Nc1cccc(NC(=O)c2ccccc2N(C)c2ccccc2)c1
InChIInChI=1S/C22H21N3O2/c1-16(26)23-17-9-8-10-18(15-17)24-22(27)20-13-6-7-14-21(20)25(2)19-11-4-3-5-12-19/h3-15H,1-2H3,(H,23,26)(H,24,27)
InChIKeyDHABMLMHXMIZCV-UHFFFAOYSA-N
XLogP4.67
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-methylanilino)-N-[3-(methylsulfonylmethyl)phenyl]benzamide
CID 86872640
N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-2-(N-methylanilino)benzamide
CID 55761158
N-[3-(cyclopropylsulfamoyl)phenyl]-2-(N-methylanilino)benzamide
CID 55759549
N-(3-acetamidophenyl)-2-chlorobenzamide
CID 792012
N-(3-acetamidophenyl)-2-phenoxybenzamide
CID 3402859
N-methoxy-2-(N-methylanilino)benzamide
CID 47216174
N-(3-acetylphenyl)-2-[benzenesulfonyl(methyl)amino]benzamide
CID 126346371
2-(N-methylanilino)-N-[3-[(Z)-(1-methylpyrrolidin-2-ylidene)amino]sulfonylphenyl]benzamide
CID 60530575
N-(3-acetamidophenyl)-4-methyl-2-(N-methylanilino)-1,3-thiazole-5-carboxamide
CID 30141884
2-[methyl(methylsulfanyl)amino]-N-phenylbenzamide
CID 166075223
N-[3-[acetyl(methyl)amino]phenyl]-2-chlorobenzamide
CID 46761791
2-[[3-(3-oxobutanoylamino)phenyl]carbamoyl]benzoic acid
CID 139947577

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide?
The IUPAC name of N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide (CID 55736923) is N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide is CC(=O)Nc1cccc(NC(=O)c2ccccc2N(C)c2ccccc2)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide?
The InChIKey is DHABMLMHXMIZCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O2/c1-16(26)23-17-9-8-10-18(15-17)24-22(27)20-13-6-7-14-21(20)25(2)19-11-4-3-5-12-19/h3-15H,1-2H3,(H,23,26)(H,24,27).
What are the key properties of N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide?
N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide has a molecular weight of 359.43 g/mol, XLogP of 4.67, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-(N-methylanilino)benzamide is sourced from PubChem (CID 55736923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).