N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide

C31H28N2O3 — CID 11236897

IUPACN-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(NC(=O)Cc3cccc(C)c3)cc2C(=O)c2ccccc2)cc1
InChIInChI=1S/C31H28N2O3/c1-21-11-13-23(14-12-21)18-30(35)33-28-16-15-26(20-27(28)31(36)25-9-4-3-5-10-25)32-29(34)19-24-8-6-7-22(2)17-24/h3-17,20H,18-19H2,1-2H3,(H,32,34)(H,33,35)
InChIKeyZVCHHJAJRSBXIX-UHFFFAOYSA-N
MW476.58 g/mol
LogP5.90
Rot. Bonds8

About N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide

N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide (PubChem CID 11236897) has the molecular formula C31H28N2O3 and a molecular weight of 476.58 g/mol. Its IUPAC name is N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide
PubChem CID11236897
Molecular FormulaC31H28N2O3
Molecular Weight476.58 g/mol
Exact Mass476.21
IUPAC NameN-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(NC(=O)Cc3cccc(C)c3)cc2C(=O)c2ccccc2)cc1
InChIInChI=1S/C31H28N2O3/c1-21-11-13-23(14-12-21)18-30(35)33-28-16-15-26(20-27(28)31(36)25-9-4-3-5-10-25)32-29(34)19-24-8-6-7-22(2)17-24/h3-17,20H,18-19H2,1-2H3,(H,32,34)(H,33,35)
InChIKeyZVCHHJAJRSBXIX-UHFFFAOYSA-N
XLogP5.90
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.58
LogP ≤ 55.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-benzoyl-4-[(2-naphthalen-2-ylacetyl)amino]phenyl]-2-(4-methylphenyl)acetamide
CID 11214428
N-[3-benzoyl-4-[[2-(4-methylphenyl)acetyl]amino]phenyl]benzamide
CID 10297535
N-[3-benzoyl-4-[[2-(4-methylphenyl)acetyl]amino]phenyl]anthracene-9-carboxamide
CID 10166062
N-[2-[3-benzoyl-4-[[2-(4-methylphenyl)acetyl]amino]anilino]-2-oxoethyl]heptadecanamide
CID 10283110
(E)-N-[3-benzoyl-4-[[2-(4-methylphenyl)acetyl]amino]phenyl]-3-[5-(4-chlorophenyl)thiophen-2-yl]prop-2-enamide
CID 101196855
N-(2-benzoyl-4-methylphenyl)-2-(4-ethoxyphenyl)acetamide
CID 8719623
2-(3-methylphenyl)-N-phenylacetamide
CID 6470005
(E)-N-[3-benzoyl-4-[[2-(4-methylphenyl)acetyl]amino]phenyl]-3-[4-(4-methylsulfonylphenyl)thiophen-2-yl]prop-2-enamide
CID 11467815
(E)-N-[3-benzoyl-4-[[2-(4-methylphenyl)acetyl]amino]phenyl]-3-[4-[4-(trifluoromethyl)phenyl]furan-2-yl]prop-2-enamide
CID 11763380
3-[[2-(3-methylphenyl)acetyl]amino]benzoic acid
CID 17127022
3-methyl-N-[4-[(2-phenylacetyl)amino]phenyl]benzamide
CID 5343922
N-(2-benzoyl-4-methylphenyl)-2-[[2-(4-methylsulfanylphenyl)acetyl]amino]benzamide
CID 41126334

Frequently Asked Questions

What is the IUPAC name of N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide (CID 11236897) is N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)Nc2ccc(NC(=O)Cc3cccc(C)c3)cc2C(=O)c2ccccc2)cc1.
What is the InChIKey of N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide?
The InChIKey is ZVCHHJAJRSBXIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H28N2O3/c1-21-11-13-23(14-12-21)18-30(35)33-28-16-15-26(20-27(28)31(36)25-9-4-3-5-10-25)32-29(34)19-24-8-6-7-22(2)17-24/h3-17,20H,18-19H2,1-2H3,(H,32,34)(H,33,35).
What are the key properties of N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide?
N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide has a molecular weight of 476.58 g/mol, XLogP of 5.90, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 11236897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).