8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol

C25H19F2N3O2 — CID 166607096

IUPAC8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol
SMILESCc1ccc(Cc2nc3c(Cc4ccccc4)nc(-c4cccc(F)c4F)cn3c2O)o1
InChIInChI=1S/C25H19F2N3O2/c1-15-10-11-17(32-15)13-21-25(31)30-14-22(18-8-5-9-19(26)23(18)27)28-20(24(30)29-21)12-16-6-3-2-4-7-16/h2-11,14,31H,12-13H2,1H3
InChIKeySJGYCWHKQNITOP-UHFFFAOYSA-N
MW431.44 g/mol
LogP5.46
Rot. Bonds5

About 8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol

8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol (PubChem CID 166607096) has the molecular formula C25H19F2N3O2 and a molecular weight of 431.44 g/mol. Its IUPAC name is 8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol.

Molecular Properties

Compound Name8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol
PubChem CID166607096
Molecular FormulaC25H19F2N3O2
Molecular Weight431.44 g/mol
Exact Mass431.14
IUPAC Name8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol
SMILESCc1ccc(Cc2nc3c(Cc4ccccc4)nc(-c4cccc(F)c4F)cn3c2O)o1
InChIInChI=1S/C25H19F2N3O2/c1-15-10-11-17(32-15)13-21-25(31)30-14-22(18-8-5-9-19(26)23(18)27)28-20(24(30)29-21)12-16-6-3-2-4-7-16/h2-11,14,31H,12-13H2,1H3
InChIKeySJGYCWHKQNITOP-UHFFFAOYSA-N
XLogP5.46
TPSA63.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.44
LogP ≤ 55.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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-methyl-3H-imidazo[4,5-b]pyridin-6-yl benzoate
CID 53322367
N-ethyl-2-(4-fluorophenyl)-N-[(5-methyl-2-furyl)methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 72866293
2-Fluoro-5-[7-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]benzonitrile
CID 118733892
7-(Furan-2-yl)-3-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 118733894
3-(4-Fluorophenyl)-7-(furan-2-yl)imidazo[1,2-a]pyridine
CID 118733895
2-ethyl-5-[2-methyl-8-[(2-methylphenyl)methoxy]imidazo[1,2-a]pyridin-3-yl]-3H-isoindol-1-one;hydrochloride
CID 145974463

Frequently Asked Questions

What is the IUPAC name of 8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol?
The IUPAC name of 8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol (CID 166607096) is 8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol.
What is the SMILES notation for 8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol?
The canonical SMILES for 8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol is Cc1ccc(Cc2nc3c(Cc4ccccc4)nc(-c4cccc(F)c4F)cn3c2O)o1.
What is the InChIKey of 8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol?
The InChIKey is SJGYCWHKQNITOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19F2N3O2/c1-15-10-11-17(32-15)13-21-25(31)30-14-22(18-8-5-9-19(26)23(18)27)28-20(24(30)29-21)12-16-6-3-2-4-7-16/h2-11,14,31H,12-13H2,1H3.
What are the key properties of 8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol?
8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol has a molecular weight of 431.44 g/mol, XLogP of 5.46, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-benzyl-6-(2,3-difluorophenyl)-2-[(5-methylfuran-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol is sourced from PubChem (CID 166607096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).