7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one

C23H19N5O3 — CID 59473373

IUPAC7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one
SMILESCOc1ccc(Nc2nc(-c3ccc4ccc(=O)[nH]c4c3)cn3ccnc23)cc1OC
InChIInChI=1S/C23H19N5O3/c1-30-19-7-6-16(12-20(19)31-2)25-22-23-24-9-10-28(23)13-18(27-22)15-4-3-14-5-8-21(29)26-17(14)11-15/h3-13H,1-2H3,(H,25,27)(H,26,29)
InChIKeyCEOTZOPACDVNIN-UHFFFAOYSA-N
MW413.44 g/mol
LogP4.00
Rot. Bonds5

About 7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one

7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one (PubChem CID 59473373) has the molecular formula C23H19N5O3 and a molecular weight of 413.44 g/mol. Its IUPAC name is 7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one.

Molecular Properties

Compound Name7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one
PubChem CID59473373
Molecular FormulaC23H19N5O3
Molecular Weight413.44 g/mol
Exact Mass413.15
IUPAC Name7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one
SMILESCOc1ccc(Nc2nc(-c3ccc4ccc(=O)[nH]c4c3)cn3ccnc23)cc1OC
InChIInChI=1S/C23H19N5O3/c1-30-19-7-6-16(12-20(19)31-2)25-22-23-24-9-10-28(23)13-18(27-22)15-4-3-14-5-8-21(29)26-17(14)11-15/h3-13H,1-2H3,(H,25,27)(H,26,29)
InChIKeyCEOTZOPACDVNIN-UHFFFAOYSA-N
XLogP4.00
TPSA93.54 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.44
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine
CID 59473196
6-(6-amino-3-pyridinyl)-N-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 59473562
6-(2,3-dihydro-1H-indol-6-yl)-N-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 59473507
5-[8-(4-ethoxy-3-methoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1,3-dihydroinden-2-one
CID 158964988
N-(3,4-dimethoxyphenyl)-6-[1-(iodomethyl)indazol-6-yl]imidazo[1,2-a]pyrazin-8-amine
CID 134327262
3-[4-[[6-(1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-2-methoxyphenoxy]propan-1-ol
CID 59473157
3-[4-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]anilino]benzoic acid
CID 68794839
[4-[[6-(1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-2-methoxyphenyl]methanol
CID 59473100
6-(1,2-dihydropyridin-5-yl)-N-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 67423925
1-[4-[[6-(1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-2-methoxyphenyl]piperidin-4-ol
CID 59473477
N-(3,4-dimethoxyphenyl)-6-[4-[1-(ethylideneamino)prop-1-en-2-yl]phenyl]imidazo[1,2-a]pyrazin-8-amine
CID 90717776
6-(3-chlorophenyl)-N-(4-ethoxy-3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 59473185

Frequently Asked Questions

What is the IUPAC name of 7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one?
The IUPAC name of 7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one (CID 59473373) is 7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one.
What is the SMILES notation for 7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one?
The canonical SMILES for 7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one is COc1ccc(Nc2nc(-c3ccc4ccc(=O)[nH]c4c3)cn3ccnc23)cc1OC.
What is the InChIKey of 7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one?
The InChIKey is CEOTZOPACDVNIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N5O3/c1-30-19-7-6-16(12-20(19)31-2)25-22-23-24-9-10-28(23)13-18(27-22)15-4-3-14-5-8-21(29)26-17(14)11-15/h3-13H,1-2H3,(H,25,27)(H,26,29).
What are the key properties of 7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one?
7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one has a molecular weight of 413.44 g/mol, XLogP of 4.00, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[8-(3,4-dimethoxyanilino)imidazo[1,2-a]pyrazin-6-yl]-1H-quinolin-2-one is sourced from PubChem (CID 59473373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).