6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one

C24H18ClFN6O2 — CID 122663682

IUPAC6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one
SMILESO=C1Cc2cc(-c3c(-c4ccc(F)cc4)nc4c(N5CCOCC5)ncc(Cl)n34)ccc2N=N1
InChIInChI=1S/C24H18ClFN6O2/c25-19-13-27-23(31-7-9-34-10-8-31)24-28-21(14-1-4-17(26)5-2-14)22(32(19)24)15-3-6-18-16(11-15)12-20(33)30-29-18/h1-6,11,13H,7-10,12H2
InChIKeyWIMUURORJOMYEO-UHFFFAOYSA-N
MW476.90 g/mol
LogP4.86
Rot. Bonds3

About 6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one

6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one (PubChem CID 122663682) has the molecular formula C24H18ClFN6O2 and a molecular weight of 476.90 g/mol. Its IUPAC name is 6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one.

Molecular Properties

Compound Name6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one
PubChem CID122663682
Molecular FormulaC24H18ClFN6O2
Molecular Weight476.90 g/mol
Exact Mass476.12
IUPAC Name6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one
SMILESO=C1Cc2cc(-c3c(-c4ccc(F)cc4)nc4c(N5CCOCC5)ncc(Cl)n34)ccc2N=N1
InChIInChI=1S/C24H18ClFN6O2/c25-19-13-27-23(31-7-9-34-10-8-31)24-28-21(14-1-4-17(26)5-2-14)22(32(19)24)15-3-6-18-16(11-15)12-20(33)30-29-18/h1-6,11,13H,7-10,12H2
InChIKeyWIMUURORJOMYEO-UHFFFAOYSA-N
XLogP4.86
TPSA84.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500476.90
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1-amino-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one
CID 122663651
3-fluoro-5-[2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]indol-1-amine
CID 122663692
4-[3-(2H-benzotriazol-5-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 122655955
4-[2-(4-fluorophenyl)-3-(1H-indol-5-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 122656030
5-[8-(azetidin-1-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one
CID 122656128
4-[6-(4-fluorophenyl)-3-methyl-1,2,4-triazin-5-yl]morpholine
CID 6405048
5-[8-(1,1-dioxo-1,4-thiazinan-4-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-1,3-dihydroindol-2-one
CID 122656008
2-(4-fluorophenyl)-4-morpholin-4-ylpyrimidine-5-carboxylic acid
CID 53214965
1-amino-5-[8-(1,1-dioxo-1,4-thiazinan-4-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-3H-indol-2-one
CID 122663669
5-chloro-6-morpholin-4-ylpyridine-3-carboxylic acid
CID 19869906
N-(5-fluoro-2-morpholin-4-yl-3-pyridinyl)pyridine-2-carboxamide
CID 164677875
[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol
CID 58824388

Frequently Asked Questions

What is the IUPAC name of 6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one?
The IUPAC name of 6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one (CID 122663682) is 6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one.
What is the SMILES notation for 6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one?
The canonical SMILES for 6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one is O=C1Cc2cc(-c3c(-c4ccc(F)cc4)nc4c(N5CCOCC5)ncc(Cl)n34)ccc2N=N1.
What is the InChIKey of 6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one?
The InChIKey is WIMUURORJOMYEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18ClFN6O2/c25-19-13-27-23(31-7-9-34-10-8-31)24-28-21(14-1-4-17(26)5-2-14)22(32(19)24)15-3-6-18-16(11-15)12-20(33)30-29-18/h1-6,11,13H,7-10,12H2.
What are the key properties of 6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one?
6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one has a molecular weight of 476.90 g/mol, XLogP of 4.86, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-chloro-2-(4-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]-4H-cinnolin-3-one is sourced from PubChem (CID 122663682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).