N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide

C28H24N2O2 — CID 4944335

IUPACN-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide
SMILESCc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(-c3ccccc3)cc2)cc1C
InChIInChI=1S/C28H24N2O2/c1-19-12-17-24(18-20(19)2)29-28(32)25-10-6-7-11-26(25)30-27(31)23-15-13-22(14-16-23)21-8-4-3-5-9-21/h3-18H,1-2H3,(H,29,32)(H,30,31)
InChIKeyMZNFLKWOGTYAGE-UHFFFAOYSA-N
MW420.51 g/mol
LogP6.48
Rot. Bonds5

About N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide

N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide (PubChem CID 4944335) has the molecular formula C28H24N2O2 and a molecular weight of 420.51 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide
PubChem CID4944335
Molecular FormulaC28H24N2O2
Molecular Weight420.51 g/mol
Exact Mass420.18
IUPAC NameN-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide
SMILESCc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(-c3ccccc3)cc2)cc1C
InChIInChI=1S/C28H24N2O2/c1-19-12-17-24(18-20(19)2)29-28(32)25-10-6-7-11-26(25)30-27(31)23-15-13-22(14-16-23)21-8-4-3-5-9-21/h3-18H,1-2H3,(H,29,32)(H,30,31)
InChIKeyMZNFLKWOGTYAGE-UHFFFAOYSA-N
XLogP6.48
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.51
LogP ≤ 56.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,4-N-bis[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]benzene-1,4-dicarboxamide
CID 4945134
2-benzamido-N-(4-phenylphenyl)benzamide
CID 5224038
2-[(4-methylbenzoyl)amino]-N-phenylbenzamide
CID 913419
2-methyl-N-[4-[(4-phenylbenzoyl)amino]phenyl]benzamide
CID 17251498
N-(2-acetylphenyl)-4-phenylbenzamide
CID 4799727
2-chloro-N-[4-[(3,4-dimethylphenyl)carbamoyl]phenyl]benzamide
CID 2990559
N-(3,4-dimethylphenyl)-4-(3-phenylquinoxalin-2-yl)benzamide
CID 23829183
N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide
CID 110602599
N,N'-bis[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]hexanediamide
CID 4945136
4-N-(2-cyanophenyl)-1-N-(3,4-dimethylphenyl)benzene-1,4-dicarboxamide
CID 109049652
N-(3,4-dimethylphenyl)-2-[(3-nitrobenzoyl)amino]benzamide
CID 4944387
methyl 3-[2-[(3,4-dimethylphenyl)carbamoyl]anilino]-3-oxopropanoate
CID 28637999

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide?
The IUPAC name of N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide (CID 4944335) is N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide is Cc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(-c3ccccc3)cc2)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide?
The InChIKey is MZNFLKWOGTYAGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N2O2/c1-19-12-17-24(18-20(19)2)29-28(32)25-10-6-7-11-26(25)30-27(31)23-15-13-22(14-16-23)21-8-4-3-5-9-21/h3-18H,1-2H3,(H,29,32)(H,30,31).
What are the key properties of N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide?
N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide has a molecular weight of 420.51 g/mol, XLogP of 6.48, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide is sourced from PubChem (CID 4944335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).