2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide

C22H21NO3 — CID 78804018

IUPAC2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)Nc2ccccc2-c2ccccc2)c1
InChIInChI=1S/C22H21NO3/c1-25-18-12-13-21(26-2)17(14-18)15-22(24)23-20-11-7-6-10-19(20)16-8-4-3-5-9-16/h3-14H,15H2,1-2H3,(H,23,24)
InChIKeyVWXNPBUSQVMKHJ-UHFFFAOYSA-N
MW347.41 g/mol
LogP4.55
Rot. Bonds6

About 2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide

2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide (PubChem CID 78804018) has the molecular formula C22H21NO3 and a molecular weight of 347.41 g/mol. Its IUPAC name is 2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide
PubChem CID78804018
Molecular FormulaC22H21NO3
Molecular Weight347.41 g/mol
Exact Mass347.15
IUPAC Name2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)Nc2ccccc2-c2ccccc2)c1
InChIInChI=1S/C22H21NO3/c1-25-18-12-13-21(26-2)17(14-18)15-22(24)23-20-11-7-6-10-19(20)16-8-4-3-5-9-16/h3-14H,15H2,1-2H3,(H,23,24)
InChIKeyVWXNPBUSQVMKHJ-UHFFFAOYSA-N
XLogP4.55
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.41
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide?
The IUPAC name of 2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide (CID 78804018) is 2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide.
What is the SMILES notation for 2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide?
The canonical SMILES for 2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide is COc1ccc(OC)c(CC(=O)Nc2ccccc2-c2ccccc2)c1.
What is the InChIKey of 2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide?
The InChIKey is VWXNPBUSQVMKHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO3/c1-25-18-12-13-21(26-2)17(14-18)15-22(24)23-20-11-7-6-10-19(20)16-8-4-3-5-9-16/h3-14H,15H2,1-2H3,(H,23,24).
What are the key properties of 2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide?
2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide has a molecular weight of 347.41 g/mol, XLogP of 4.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide is sourced from PubChem (CID 78804018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).