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

C24H18FN3O2 — CID 166607091

IUPAC8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol
SMILESOc1c(Cc2ccco2)nc2c(Cc3ccccc3)nc(-c3cccc(F)c3)cn12
InChIInChI=1S/C24H18FN3O2/c25-18-9-4-8-17(13-18)22-15-28-23(20(26-22)12-16-6-2-1-3-7-16)27-21(24(28)29)14-19-10-5-11-30-19/h1-11,13,15,29H,12,14H2
InChIKeyDBTWQTYVTNMTQF-UHFFFAOYSA-N
MW399.43 g/mol
LogP5.02
Rot. Bonds5

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

8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol (PubChem CID 166607091) has the molecular formula C24H18FN3O2 and a molecular weight of 399.43 g/mol. Its IUPAC name is 8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol.

Molecular Properties

Compound Name8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol
PubChem CID166607091
Molecular FormulaC24H18FN3O2
Molecular Weight399.43 g/mol
Exact Mass399.14
IUPAC Name8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol
SMILESOc1c(Cc2ccco2)nc2c(Cc3ccccc3)nc(-c3cccc(F)c3)cn12
InChIInChI=1S/C24H18FN3O2/c25-18-9-4-8-17(13-18)22-15-28-23(20(26-22)12-16-6-2-1-3-7-16)27-21(24(28)29)14-19-10-5-11-30-19/h1-11,13,15,29H,12,14H2
InChIKeyDBTWQTYVTNMTQF-UHFFFAOYSA-N
XLogP5.02
TPSA63.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.43
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-{3-[(Furan-2-ylmethyl)-amino]-imidazo[1,2-a]pyridin-2-yl}-phenol
CID 858019
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
N-[2-ethyl-8-[2-(4-fluorophenyl)-2-oxoethoxy]imidazo[1,2-a]pyridin-3-yl]-N,2-dimethylpropanamide
CID 49778795
N-[2-ethyl-8-[2-(4-fluorophenyl)-2-oxoethoxy]imidazo[1,2-a]pyridin-3-yl]-N-methyl-2-phenoxyacetamide
CID 49786482
N-[2-ethyl-8-(3-methylbut-2-enoxy)imidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide
CID 49789736
N-[8-(cyclohexylmethoxy)-2-ethylimidazo[1,2-a]pyridin-3-yl]-2-fluoro-N-methylbenzamide
CID 49791079
3-Benzyl-2-(furan-2-yl)-6-methylimidazo[1,2-a]pyridine
CID 51359014
3-[(3-Fluorophenyl)methyl]-2-(2-furanyl)imidazo[2,1-a]isoquinoline
CID 51359072
2-Fluoro-5-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]benzonitrile
CID 118733892
2-[4-[7-(Furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile
CID 118733893
7-(Furan-2-yl)-3-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 118733894

Frequently Asked Questions

What is the IUPAC name of 8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol?
The IUPAC name of 8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol (CID 166607091) is 8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol.
What is the SMILES notation for 8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol?
The canonical SMILES for 8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol is Oc1c(Cc2ccco2)nc2c(Cc3ccccc3)nc(-c3cccc(F)c3)cn12.
What is the InChIKey of 8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol?
The InChIKey is DBTWQTYVTNMTQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18FN3O2/c25-18-9-4-8-17(13-18)22-15-28-23(20(26-22)12-16-6-2-1-3-7-16)27-21(24(28)29)14-19-10-5-11-30-19/h1-11,13,15,29H,12,14H2.
What are the key properties of 8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol?
8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol has a molecular weight of 399.43 g/mol, XLogP of 5.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-benzyl-6-(3-fluorophenyl)-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol is sourced from PubChem (CID 166607091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).