2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide

C28H24N2O3 — CID 990917

IUPAC2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1ccccc1NC(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H24N2O3/c1-33-25-19-11-10-18-24(25)30-27(31)22-16-8-9-17-23(22)29-28(32)26(20-12-4-2-5-13-20)21-14-6-3-7-15-21/h2-19,26H,1H3,(H,29,32)(H,30,31)
InChIKeyGARKZPAWNWMNMV-UHFFFAOYSA-N
MW436.51 g/mol
LogP5.72
Rot. Bonds7

About 2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide

2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide (PubChem CID 990917) has the molecular formula C28H24N2O3 and a molecular weight of 436.51 g/mol. Its IUPAC name is 2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide.

Molecular Properties

Compound Name2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide
PubChem CID990917
Molecular FormulaC28H24N2O3
Molecular Weight436.51 g/mol
Exact Mass436.18
IUPAC Name2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1ccccc1NC(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H24N2O3/c1-33-25-19-11-10-18-24(25)30-27(31)22-16-8-9-17-23(22)29-28(32)26(20-12-4-2-5-13-20)21-14-6-3-7-15-21/h2-19,26H,1H3,(H,29,32)(H,30,31)
InChIKeyGARKZPAWNWMNMV-UHFFFAOYSA-N
XLogP5.72
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms33
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.51
LogP ≤ 55.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide?
The IUPAC name of 2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide (CID 990917) is 2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide.
What is the SMILES notation for 2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide?
The canonical SMILES for 2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide is COc1ccccc1NC(=O)c1ccccc1NC(=O)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide?
The InChIKey is GARKZPAWNWMNMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N2O3/c1-33-25-19-11-10-18-24(25)30-27(31)22-16-8-9-17-23(22)29-28(32)26(20-12-4-2-5-13-20)21-14-6-3-7-15-21/h2-19,26H,1H3,(H,29,32)(H,30,31).
What are the key properties of 2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide?
2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide has a molecular weight of 436.51 g/mol, XLogP of 5.72, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-diphenylacetyl)amino]-N-(2-methoxyphenyl)benzamide is sourced from PubChem (CID 990917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).