2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide

C22H21NO — CID 2116000

IUPAC2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccccc2-c2ccccc2)cc1C
InChIInChI=1S/C22H21NO/c1-16-12-13-18(14-17(16)2)15-22(24)23-21-11-7-6-10-20(21)19-8-4-3-5-9-19/h3-14H,15H2,1-2H3,(H,23,24)
InChIKeyKFEKPYWFZHKIQO-UHFFFAOYSA-N
MW315.42 g/mol
LogP5.15
Rot. Bonds4

About 2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide

2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide (PubChem CID 2116000) has the molecular formula C22H21NO and a molecular weight of 315.42 g/mol. Its IUPAC name is 2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide.

Molecular Properties

Compound Name2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide
PubChem CID2116000
Molecular FormulaC22H21NO
Molecular Weight315.42 g/mol
Exact Mass315.16
IUPAC Name2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccccc2-c2ccccc2)cc1C
InChIInChI=1S/C22H21NO/c1-16-12-13-18(14-17(16)2)15-22(24)23-21-11-7-6-10-20(21)19-8-4-3-5-9-19/h3-14H,15H2,1-2H3,(H,23,24)
InChIKeyKFEKPYWFZHKIQO-UHFFFAOYSA-N
XLogP5.15
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.42
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide?
The IUPAC name of 2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide (CID 2116000) is 2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide.
What is the SMILES notation for 2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide?
The canonical SMILES for 2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide is Cc1ccc(CC(=O)Nc2ccccc2-c2ccccc2)cc1C.
What is the InChIKey of 2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide?
The InChIKey is KFEKPYWFZHKIQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO/c1-16-12-13-18(14-17(16)2)15-22(24)23-21-11-7-6-10-20(21)19-8-4-3-5-9-19/h3-14H,15H2,1-2H3,(H,23,24).
What are the key properties of 2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide?
2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide has a molecular weight of 315.42 g/mol, XLogP of 5.15, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenyl)-N-(2-phenylphenyl)acetamide is sourced from PubChem (CID 2116000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).