2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide

C26H23N3O — CID 143000963

IUPAC2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide
SMILESCc1ccc(CC(=O)Nc2ncc(-c3ccccc3)nc2-c2ccccc2)cc1C
InChIInChI=1S/C26H23N3O/c1-18-13-14-20(15-19(18)2)16-24(30)29-26-25(22-11-7-4-8-12-22)28-23(17-27-26)21-9-5-3-6-10-21/h3-15,17H,16H2,1-2H3,(H,27,29,30)
InChIKeyRHUUXJSAVSHVAX-UHFFFAOYSA-N
MW393.49 g/mol
LogP5.61
Rot. Bonds5

About 2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide

2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide (PubChem CID 143000963) has the molecular formula C26H23N3O and a molecular weight of 393.49 g/mol. Its IUPAC name is 2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide.

Molecular Properties

Compound Name2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide
PubChem CID143000963
Molecular FormulaC26H23N3O
Molecular Weight393.49 g/mol
Exact Mass393.18
IUPAC Name2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide
SMILESCc1ccc(CC(=O)Nc2ncc(-c3ccccc3)nc2-c2ccccc2)cc1C
InChIInChI=1S/C26H23N3O/c1-18-13-14-20(15-19(18)2)16-24(30)29-26-25(22-11-7-4-8-12-22)28-23(17-27-26)21-9-5-3-6-10-21/h3-15,17H,16H2,1-2H3,(H,27,29,30)
InChIKeyRHUUXJSAVSHVAX-UHFFFAOYSA-N
XLogP5.61
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.49
LogP ≤ 55.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-N-[3-(4-hydroxyphenyl)-5-phenylpyrazin-2-yl]acetamide
CID 136624974
ethane;N-(3-ethyl-5-phenylpyrazin-2-yl)-2-(4-methylphenyl)acetamide
CID 143000025
N-[3,5-bis(4-hydroxyphenyl)pyrazin-2-yl]-3-phenylpropanamide
CID 137101630
2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide
CID 143001007
2-(3,4-difluorophenyl)-N-[3-(2-methylprop-1-enyl)-5-phenylpyrazin-2-yl]acetamide
CID 70830301
N-(3-cyclohexyl-5-phenylpyrazin-2-yl)-2-(3,4-difluorophenyl)acetamide
CID 123435419
N-[5-(4-hydroxyphenyl)-3-thiophen-2-ylpyrazin-2-yl]-2-(4-methylphenyl)acetamide
CID 143001238
2-(4-bromophenyl)-N-[5-(4-fluorophenyl)-3-(4-hydroxyphenyl)pyrazin-2-yl]acetamide
CID 140639417
2-phenyl-N-[5-phenyl-3-(2-phenylethenyl)pyrazin-2-yl]acetamide
CID 77496875
N-[5-(4-hydroxyphenyl)-3-[hydroxy(phenyl)methyl]pyrazin-2-yl]-2-(4-methylphenyl)acetamide
CID 143001080
2-cyclohexyl-N-(3,5-diphenylpyrazin-2-yl)acetamide;N-(3,5-diphenylpyrazin-2-yl)acetamide;N-(3,5-diphenylpyrazin-2-yl)benzamide;N-(3,5-diphenylpyrazin-2-yl)-2-naphthalen-2-ylacetamide;N-(3,5-diphenylpyrazin-2-yl)-2-phenylacetamide;N-(3,5-diphenylpyrazin-2-yl)-4-phenylbutanamide;N-(3,5-diphenylpyrazin-2-yl)-3-phenylpropanamide
CID 159829946
2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-N-[5-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-3-[4-(dimethylamino)phenyl]pyrazin-2-yl]acetamide
CID 67432425

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide?
The IUPAC name of 2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide (CID 143000963) is 2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide.
What is the SMILES notation for 2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide?
The canonical SMILES for 2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide is Cc1ccc(CC(=O)Nc2ncc(-c3ccccc3)nc2-c2ccccc2)cc1C.
What is the InChIKey of 2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide?
The InChIKey is RHUUXJSAVSHVAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N3O/c1-18-13-14-20(15-19(18)2)16-24(30)29-26-25(22-11-7-4-8-12-22)28-23(17-27-26)21-9-5-3-6-10-21/h3-15,17H,16H2,1-2H3,(H,27,29,30).
What are the key properties of 2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide?
2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide has a molecular weight of 393.49 g/mol, XLogP of 5.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide is sourced from PubChem (CID 143000963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).