8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol

C25H21N3O3 — CID 146403959

IUPAC8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol
SMILESCc1c(O)cccc1-c1cn2c(O)c(Cc3ccco3)nc2c(Cc2ccccc2)n1
InChIInChI=1S/C25H21N3O3/c1-16-19(10-5-11-23(16)29)22-15-28-24(20(26-22)13-17-7-3-2-4-8-17)27-21(25(28)30)14-18-9-6-12-31-18/h2-12,15,29-30H,13-14H2,1H3
InChIKeyWVCXEQCKBAGYPN-UHFFFAOYSA-N
MW411.46 g/mol
LogP4.89
Rot. Bonds5

About 8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol

8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol (PubChem CID 146403959) has the molecular formula C25H21N3O3 and a molecular weight of 411.46 g/mol. Its IUPAC name is 8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol.

Molecular Properties

Compound Name8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol
PubChem CID146403959
Molecular FormulaC25H21N3O3
Molecular Weight411.46 g/mol
Exact Mass411.16
IUPAC Name8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol
SMILESCc1c(O)cccc1-c1cn2c(O)c(Cc3ccco3)nc2c(Cc2ccccc2)n1
InChIInChI=1S/C25H21N3O3/c1-16-19(10-5-11-23(16)29)22-15-28-24(20(26-22)13-17-7-3-2-4-8-17)27-21(25(28)30)14-18-9-6-12-31-18/h2-12,15,29-30H,13-14H2,1H3
InChIKeyWVCXEQCKBAGYPN-UHFFFAOYSA-N
XLogP4.89
TPSA83.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.46
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol with MolForge

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Related Compounds

(Rac)-PF-06256142
CID 75201901
N-(2,6-dimethylbenzyl)-6-(furan-2-yl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine
CID 24890348
3-({6-[(6-Methoxypyridin-3-yl)oxy]-1-methyl-1H-benzimidazol-2-yl}methoxy)benzoic acid
CID 46909009
3-[[5-(3,4-Dimethylphenoxy)-3-methylimidazo[4,5-b]pyridin-2-yl]methoxy]benzoic acid
CID 68661980
4-(4-Imidazo[1,2-a]pyridin-5-yl-3-methylphenoxy)furo[3,2-c]pyridine
CID 130442473
4-[3-Methyl-4-(6-methylimidazo[1,2-a]pyridin-5-yl)phenoxy]furo[3,2-c]pyridine
CID 130442514
4-[3-Methyl-4-(2-methylimidazo[1,2-a]pyrazin-3-yl)phenoxy]furo[3,2-c]pyridine
CID 130442590
5-Dibenzofuran-4-ylimidazo[1,2-a]pyridine
CID 46942625
N-[2-ethyl-8-[(3-methoxyphenyl)methoxy]imidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide
CID 46943153
Methyl 2-[[2-ethyl-3-[methyl(pyridine-4-carbonyl)amino]imidazo[1,2-a]pyridin-8-yl]oxymethyl]benzoate
CID 49789690
3-Benzyl-2-(furan-2-yl)-6-methylimidazo[1,2-a]pyridine
CID 51359014
3-Benzyl-2-(furan-2-yl)imidazo[2,1-a]isoquinoline
CID 51359022

Frequently Asked Questions

What is the IUPAC name of 8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol?
The IUPAC name of 8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol (CID 146403959) is 8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol.
What is the SMILES notation for 8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol?
The canonical SMILES for 8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol is Cc1c(O)cccc1-c1cn2c(O)c(Cc3ccco3)nc2c(Cc2ccccc2)n1.
What is the InChIKey of 8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol?
The InChIKey is WVCXEQCKBAGYPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N3O3/c1-16-19(10-5-11-23(16)29)22-15-28-24(20(26-22)13-17-7-3-2-4-8-17)27-21(25(28)30)14-18-9-6-12-31-18/h2-12,15,29-30H,13-14H2,1H3.
What are the key properties of 8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol?
8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol has a molecular weight of 411.46 g/mol, XLogP of 4.89, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-benzyl-2-(furan-2-ylmethyl)-6-(3-hydroxy-2-methylphenyl)imidazo[1,2-a]pyrazin-3-ol is sourced from PubChem (CID 146403959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).