2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide

C26H25N5O2 — CID 123722516

IUPAC2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide
SMILESO=C(CN1CCN(c2ccc(O)cc2)CC1)Nc1cccc(-c2cnc3ccccc3n2)c1
InChIInChI=1S/C26H25N5O2/c32-22-10-8-21(9-11-22)31-14-12-30(13-15-31)18-26(33)28-20-5-3-4-19(16-20)25-17-27-23-6-1-2-7-24(23)29-25/h1-11,16-17,32H,12-15,18H2,(H,28,33)
InChIKeyCHWAGAATRCVYKE-UHFFFAOYSA-N
MW439.52 g/mol
LogP3.76
Rot. Bonds5

About 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide

2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide (PubChem CID 123722516) has the molecular formula C26H25N5O2 and a molecular weight of 439.52 g/mol. Its IUPAC name is 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide
PubChem CID123722516
Molecular FormulaC26H25N5O2
Molecular Weight439.52 g/mol
Exact Mass439.20
IUPAC Name2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide
SMILESO=C(CN1CCN(c2ccc(O)cc2)CC1)Nc1cccc(-c2cnc3ccccc3n2)c1
InChIInChI=1S/C26H25N5O2/c32-22-10-8-21(9-11-22)31-14-12-30(13-15-31)18-26(33)28-20-5-3-4-19(16-20)25-17-27-23-6-1-2-7-24(23)29-25/h1-11,16-17,32H,12-15,18H2,(H,28,33)
InChIKeyCHWAGAATRCVYKE-UHFFFAOYSA-N
XLogP3.76
TPSA81.59 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.52
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-ethylphenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 8691104
N-(3-quinoxalin-2-ylphenyl)carbamoyl chloride
CID 73427550
N-(3-chloro-4-methylphenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 8690802
N-(4,6-diphenylpyrimidin-2-yl)-2-(4-phenylpiperazin-1-yl)acetamide
CID 50751160
N-(4-bromo-3-methylphenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 8690820
4-bromo-N-(3-quinoxalin-2-ylphenyl)benzamide
CID 2233095
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-(3-methylphenyl)acetamide
CID 6466210
N-(3-acetylphenyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]acetamide
CID 7935502
2-[4-(4-fluorophenyl)piperazin-1-yl]-N-(5-hydroxy-2-pyridinyl)acetamide
CID 135126584
3-methyl-N-(3-quinoxalin-2-ylphenyl)benzamide
CID 2224328
1-(4-methoxyphenyl)-3-(3-quinoxalin-2-ylphenyl)urea
CID 1485415
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 8690878

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide?
The IUPAC name of 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide (CID 123722516) is 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide.
What is the SMILES notation for 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide?
The canonical SMILES for 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide is O=C(CN1CCN(c2ccc(O)cc2)CC1)Nc1cccc(-c2cnc3ccccc3n2)c1.
What is the InChIKey of 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide?
The InChIKey is CHWAGAATRCVYKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N5O2/c32-22-10-8-21(9-11-22)31-14-12-30(13-15-31)18-26(33)28-20-5-3-4-19(16-20)25-17-27-23-6-1-2-7-24(23)29-25/h1-11,16-17,32H,12-15,18H2,(H,28,33).
What are the key properties of 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide?
2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide has a molecular weight of 439.52 g/mol, XLogP of 3.76, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(3-quinoxalin-2-ylphenyl)acetamide is sourced from PubChem (CID 123722516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).