4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide

C18H18N2O3 — CID 122150958

IUPAC4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2cccc(C)c2C(C)=O)cc1
InChIInChI=1S/C18H18N2O3/c1-11-5-4-6-16(17(11)12(2)21)20-18(23)14-7-9-15(10-8-14)19-13(3)22/h4-10H,1-3H3,(H,19,22)(H,20,23)
InChIKeySPCVZOCGKKCSGU-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.41
Rot. Bonds4

About 4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide

4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide (PubChem CID 122150958) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is 4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide.

Molecular Properties

Compound Name4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide
PubChem CID122150958
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2cccc(C)c2C(C)=O)cc1
InChIInChI=1S/C18H18N2O3/c1-11-5-4-6-16(17(11)12(2)21)20-18(23)14-7-9-15(10-8-14)19-13(3)22/h4-10H,1-3H3,(H,19,22)(H,20,23)
InChIKeySPCVZOCGKKCSGU-UHFFFAOYSA-N
XLogP3.41
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-acetamido-N-(3-acetamido-2-methylphenyl)benzamide
CID 134019280
4-acetamido-N-(2-aminophenyl)benzamide
CID 2746
1-N-(4-acetylphenyl)-3-N-(2,3-dimethylphenyl)benzene-1,3-dicarboxamide
CID 109057272
2,6-dimethoxy-N-[4-[(2-methylphenyl)carbamoyl]phenyl]benzamide
CID 142804897
N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide
CID 2223178
N-(2,3-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide
CID 977709
3-methyl-N-[4-[(2-methylphenyl)carbamoyl]phenyl]benzamide
CID 23857052
N-(4-acetamidophenyl)-3-iodo-4-methylbenzamide
CID 1014195
2-acetamido-6-methylbenzoic acid
CID 2801400
N-(2-carbamothioyl-3-methylphenyl)benzamide
CID 107805642
4-N-(2,6-dimethylphenyl)-1-N-(2-methylphenyl)benzene-1,4-dicarboxamide
CID 109049294
2-N-(4-acetylphenyl)-6-N-(2-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100082

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide?
The IUPAC name of 4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide (CID 122150958) is 4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide.
What is the SMILES notation for 4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide?
The canonical SMILES for 4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide is CC(=O)Nc1ccc(C(=O)Nc2cccc(C)c2C(C)=O)cc1.
What is the InChIKey of 4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide?
The InChIKey is SPCVZOCGKKCSGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-11-5-4-6-16(17(11)12(2)21)20-18(23)14-7-9-15(10-8-14)19-13(3)22/h4-10H,1-3H3,(H,19,22)(H,20,23).
What are the key properties of 4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide?
4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide has a molecular weight of 310.35 g/mol, XLogP of 3.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide is sourced from PubChem (CID 122150958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).