2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one

C21H19N3O2 — CID 53118167

IUPAC2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one
SMILESCOc1ccc(-n2ccn3cc(-c4ccc(C)c(C)c4)nc3c2=O)cc1
InChIInChI=1S/C21H19N3O2/c1-14-4-5-16(12-15(14)2)19-13-23-10-11-24(21(25)20(23)22-19)17-6-8-18(26-3)9-7-17/h4-13H,1-3H3
InChIKeyWAAXOGZNNTZGDJ-UHFFFAOYSA-N
MW345.40 g/mol
LogP3.78
Rot. Bonds3

About 2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one

2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one (PubChem CID 53118167) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is 2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one.

Molecular Properties

Compound Name2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one
PubChem CID53118167
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC Name2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one
SMILESCOc1ccc(-n2ccn3cc(-c4ccc(C)c(C)c4)nc3c2=O)cc1
InChIInChI=1S/C21H19N3O2/c1-14-4-5-16(12-15(14)2)19-13-23-10-11-24(21(25)20(23)22-19)17-6-8-18(26-3)9-7-17/h4-13H,1-3H3
InChIKeyWAAXOGZNNTZGDJ-UHFFFAOYSA-N
XLogP3.78
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(4-methoxyphenyl)benzimidazol-5-yl]-N-[(4-propan-2-ylphenyl)methyl]acetamide
CID 24748634
1-(4-Methoxy-phenyl)-2-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium
CID 16235770
1-(4-Difluoromethoxy-phenyl)-3-p-tolyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium
CID 16682049
(1-(4-methoxyphenyl)-2-p-tolyl-1H-imidazol-4-yl)(4-(naphthalen-2-yl)piperazin-1-yl)methanone
CID 24785177
2-[4-(3-Methoxy-4-methylphenyl)-2-phenylimidazol-1-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 71573458
7-benzyl-N-(4-methoxyphenyl)-N,2,5-trimethylpyrrolo[3,2-d]pyrimidin-4-amine
CID 73669133
1-(4-Methoxyphenyl)-2-methylsulfanyl-4-phenylimidazole
CID 4133303
1-(4-methoxyphenyl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-4-ium bromide
CID 15885886
N-(4-methoxyphenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine
CID 16193051
4-(1-benzyl-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-4-phenylpiperidine-1-carboxamide
CID 44406306
4-(6-fluoro-2''-(trifluoromethoxy)biphenyl-3-yl)-1-methyl-1H-imidazole-2-carboxamide
CID 49866244
3-(4-Ethoxyphenyl)-6-[(4-ethylphenyl)methylamino]imidazo[4,5-b]pyridine-2-carboxamide
CID 71520881

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one?
The IUPAC name of 2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one (CID 53118167) is 2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one.
What is the SMILES notation for 2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one?
The canonical SMILES for 2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one is COc1ccc(-n2ccn3cc(-c4ccc(C)c(C)c4)nc3c2=O)cc1.
What is the InChIKey of 2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one?
The InChIKey is WAAXOGZNNTZGDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O2/c1-14-4-5-16(12-15(14)2)19-13-23-10-11-24(21(25)20(23)22-19)17-6-8-18(26-3)9-7-17/h4-13H,1-3H3.
What are the key properties of 2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one?
2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one has a molecular weight of 345.40 g/mol, XLogP of 3.78, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenyl)-7-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-one is sourced from PubChem (CID 53118167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).