2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide

C24H18N4O4 — CID 143001007

IUPAC2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide
SMILESO=Nc1ccc(-c2cnc(NC(=O)Cc3ccc(O)cc3)c(-c3ccc(O)cc3)n2)cc1
InChIInChI=1S/C24H18N4O4/c29-19-9-1-15(2-10-19)13-22(31)27-24-23(17-5-11-20(30)12-6-17)26-21(14-25-24)16-3-7-18(28-32)8-4-16/h1-12,14,29-30H,13H2,(H,25,27,31)
InChIKeyXBIMZEKYRUQJNH-UHFFFAOYSA-N
MW426.43 g/mol
LogP4.80
Rot. Bonds6

About 2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide

2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide (PubChem CID 143001007) has the molecular formula C24H18N4O4 and a molecular weight of 426.43 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide
PubChem CID143001007
Molecular FormulaC24H18N4O4
Molecular Weight426.43 g/mol
Exact Mass426.13
IUPAC Name2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide
SMILESO=Nc1ccc(-c2cnc(NC(=O)Cc3ccc(O)cc3)c(-c3ccc(O)cc3)n2)cc1
InChIInChI=1S/C24H18N4O4/c29-19-9-1-15(2-10-19)13-22(31)27-24-23(17-5-11-20(30)12-6-17)26-21(14-25-24)16-3-7-18(28-32)8-4-16/h1-12,14,29-30H,13H2,(H,25,27,31)
InChIKeyXBIMZEKYRUQJNH-UHFFFAOYSA-N
XLogP4.80
TPSA124.77 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.43
LogP ≤ 54.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

2-(4-chlorophenyl)-N-[3-(4-hydroxyphenyl)-5-phenylpyrazin-2-yl]acetamide
CID 136624974
2-(4-bromophenyl)-N-[5-(4-fluorophenyl)-3-(4-hydroxyphenyl)pyrazin-2-yl]acetamide
CID 140639417
N-[3,5-bis(4-hydroxyphenyl)pyrazin-2-yl]-3-phenylpropanamide
CID 137101630
N-[5-(4-hydroxyphenyl)-3-thiophen-2-ylpyrazin-2-yl]-2-(4-methylphenyl)acetamide
CID 143001238
N-[3,5-bis(4-hydroxyphenyl)pyrazin-2-yl]-2-methylbutanamide
CID 136624987
2-(4-hydroxyphenyl)-N-[5-(4-hydroxyphenyl)-3-[(E)-2-phenylethenyl]pyrazin-2-yl]acetamide
CID 135980268
2-(3,4-dimethylphenyl)-N-(3,5-diphenylpyrazin-2-yl)acetamide
CID 143000963
N-[5-[4-(hydroxymethyl)phenyl]-3-(2-methylpropyl)pyrazin-2-yl]-2-(4-hydroxyphenyl)acetamide
CID 123569135
2-(4-hydroxyphenyl)-N-[3-(2-methylpropyl)-5-(4-phosphanylphenyl)pyrazin-2-yl]acetamide
CID 143000180
N-[5-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-3-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]pyrazin-2-yl]-2-[4-[2-[hydroxy(dimethyl)silyl]-2-methylpropyl]phenyl]acetamide
CID 90138567
N-[5-(4-hydroxyphenyl)-3-[hydroxy(phenyl)methyl]pyrazin-2-yl]-2-(4-methylphenyl)acetamide
CID 143001080
N-[5-(4-hydroxyphenyl)-3-[(E)-2-phenylethenyl]pyrazin-2-yl]-2-(4-iodophenyl)acetamide
CID 136625436

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide?
The IUPAC name of 2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide (CID 143001007) is 2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide.
What is the SMILES notation for 2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide?
The canonical SMILES for 2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide is O=Nc1ccc(-c2cnc(NC(=O)Cc3ccc(O)cc3)c(-c3ccc(O)cc3)n2)cc1.
What is the InChIKey of 2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide?
The InChIKey is XBIMZEKYRUQJNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N4O4/c29-19-9-1-15(2-10-19)13-22(31)27-24-23(17-5-11-20(30)12-6-17)26-21(14-25-24)16-3-7-18(28-32)8-4-16/h1-12,14,29-30H,13H2,(H,25,27,31).
What are the key properties of 2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide?
2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide has a molecular weight of 426.43 g/mol, XLogP of 4.80, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)-N-[3-(4-hydroxyphenyl)-5-(4-nitrosophenyl)pyrazin-2-yl]acetamide is sourced from PubChem (CID 143001007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).