8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one

C23H25N3O2 — CID 123410063

IUPAC8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one
SMILESCCCCC1N=C2C(Cc3ccccc3)=NC(c3ccc(O)cc3)CN2C1=O
InChIInChI=1S/C23H25N3O2/c1-2-3-9-19-23(28)26-15-21(17-10-12-18(27)13-11-17)24-20(22(26)25-19)14-16-7-5-4-6-8-16/h4-8,10-13,19,21,27H,2-3,9,14-15H2,1H3
InChIKeyCSQZNKAPMSGYEU-UHFFFAOYSA-N
MW375.47 g/mol
LogP3.93
Rot. Bonds6

About 8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one

8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one (PubChem CID 123410063) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is 8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one.

Molecular Properties

Compound Name8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one
PubChem CID123410063
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC Name8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one
SMILESCCCCC1N=C2C(Cc3ccccc3)=NC(c3ccc(O)cc3)CN2C1=O
InChIInChI=1S/C23H25N3O2/c1-2-3-9-19-23(28)26-15-21(17-10-12-18(27)13-11-17)24-20(22(26)25-19)14-16-7-5-4-6-8-16/h4-8,10-13,19,21,27H,2-3,9,14-15H2,1H3
InChIKeyCSQZNKAPMSGYEU-UHFFFAOYSA-N
XLogP3.93
TPSA65.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-hydroxyphenyl)-3-(2-phenylethyl)-5,6,7,7a-tetrahydro-4aH-cyclopenta[d]pyrimidin-4-one
CID 135964370
Aequorin
CID 2829
8-Benzyl-2-hydroxy-2-(4-hydroxy-benzyl)-6-(4-hydroxy-phenyl)-2H-imidazo[1,2-A]pyrazin-3-one
CID 5287994
c2-Hydroperoxy-coelenterazine
CID 5288011
(2S)-1-[(4-fluorophenyl)methyl]-N'-[(4-hydroxyphenyl)methyl]-5-oxopyrrolidine-2-carboximidamide;hydrochloride
CID 155512008
(2S)-1-benzyl-N'-[(4-hydroxyphenyl)methyl]-5-oxopyrrolidine-2-carboximidamide;hydrochloride
CID 155523327
(2S)-N'-[(4-hydroxyphenyl)methyl]-1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboximidamide;hydrochloride
CID 155548915
(2Z)-8-benzyl-2-[(2-fluorophenyl)methylidene]-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-one
CID 101164052
(2Z)-8-benzyl-2-[(2,4-difluorophenyl)methylidene]-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-one
CID 101809708
(2Z)-8-benzyl-2-[(2,6-difluorophenyl)methylidene]-6-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-one
CID 101809709
8-Benzyl-2-hydroperoxy-6-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methyl]imidazo[1,2-a]pyrazin-3-one
CID 2507
2-Butyl-3-[[4-(2-fluoro-5-hydroxyphenyl)phenyl]methyl]-1,3-diazaspiro[4.5]dec-1-en-4-one
CID 59138181

Frequently Asked Questions

What is the IUPAC name of 8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one?
The IUPAC name of 8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one (CID 123410063) is 8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one.
What is the SMILES notation for 8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one?
The canonical SMILES for 8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one is CCCCC1N=C2C(Cc3ccccc3)=NC(c3ccc(O)cc3)CN2C1=O.
What is the InChIKey of 8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one?
The InChIKey is CSQZNKAPMSGYEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-2-3-9-19-23(28)26-15-21(17-10-12-18(27)13-11-17)24-20(22(26)25-19)14-16-7-5-4-6-8-16/h4-8,10-13,19,21,27H,2-3,9,14-15H2,1H3.
What are the key properties of 8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one?
8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one has a molecular weight of 375.47 g/mol, XLogP of 3.93, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-benzyl-2-butyl-6-(4-hydroxyphenyl)-5,6-dihydro-2H-imidazo[1,2-a]pyrazin-3-one is sourced from PubChem (CID 123410063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).